Results for:
chemical Classification: oxazoles

2-methyl-1,3-benzoxazole

Compound Details

Synonymous names
2-Methylbenzoxazole
95-21-6
2-Methylbenzo[d]oxazole
2-Methyl-1,3-benzoxazole
2-Methylbenzoxazol
BENZOXAZOLE, 2-METHYL-
2-methyl-benzoxazole
USAF EK-982
2-Methyl-4,5-benzoxazole
Benzoxazole, methyl-
2-methyl-benzooxazole
2-Methyl-4,5-benzo-oxazole
MFCD00005771
Z0P021V3TI
NSC-3824
92609-49-9
2-Methylbenzoxazole, 99%
2-Methylbenzoxazol [Czech]
NSC 3824
EINECS 202-399-9
UNII-Z0P021V3TI
2-methyl benzoxazole
SCHEMBL129661
2-Methyl-1,3-benzoxazole #
SCHEMBL11209434
(Quinazolin-4-yloxy)-aceticacid
CHEBI:51603
WLN: T56 BN DOJ C1
DTXSID50870432
NSC3824
AC1636
AKOS000120967
DS-7378
HY-W038287
MCULE-7268173542
AC-19517
PD158366
SY048477
DB-057567
2-METHYL-4,5-BENZO-OXAZOLE [FHFI]
CS-0095153
M0557
NS00012852
EN300-16572
W-100171
Q27122675
F0001-2269
InChI=1/C8H7NO/c1-6-9-7-4-2-3-5-8(7)10-6/h2-5H,1H
Microorganism:

Yes

IUPAC name2-methyl-1,3-benzoxazole
SMILESCC1=NC2=CC=CC=C2O1
InchiInChI=1S/C8H7NO/c1-6-9-7-4-2-3-5-8(7)10-6/h2-5H,1H3
FormulaC8H7NO
PubChem ID7225
Molweight133.15
LogP2.2
Atoms10
Bonds0
H-bond Acceptor2
H-bond Donor0
Chemical Classificationnitrogen compounds aromatic compounds heterocyclic compounds benzenoids oxazoles
CHEBI-ID51603
Supernatural-IDSN0072890

mVOC Specific Details

Massbank-Links

Species emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
ProkaryotaPseudomonas AeruginosaNANABean et al. 2012
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
ProkaryotaPseudomonas Aeruginosalysogeny brothSPME/GCxGC-MSno


2,4,5-trimethyl-1,3-oxazole

Mass-Spectra

Compound Details

Synonymous names
FEMA 4394
2,4,5-TRIMETHYLOXAZOLE
20662-84-4
Trimethyloxazole
Oxazole, trimethyl-
2,4,5-Trimethyl-1,3-oxazole
Oxazole, 2,4,5-trimethyl-
trimethyl-1,3-oxazole
B04PF51WXI
Oxazole, 2,4,5-trimethyl
MFCD00005308
EINECS 243-952-4
2,4,5-Trimethyl oxazole
UNII-B04PF51WXI
Trimethyl-Oxazole
2,4,5-trimethyl-oxazole
SCHEMBL76903
TRIMETHYLOXAZOLE [FHFI]
DTXSID0022274
FEMA NO. 4394
2,4,5-Trimethyloxazole, 95%
CHEBI:179309
2,4,5-Trimethyl-1,3-oxazole #
2,4,5-Trimethyloxazole, 99%, FG
AKOS015900489
DS-3980
DB-045329
CS-0153589
NS00021839
T2595
A814792
W-107601
Q27274214
InChI=1/C6H9NO/c1-4-5(2)8-6(3)7-4/h1-3H
Microorganism:

Yes

IUPAC name2,4,5-trimethyl-1,3-oxazole
SMILESCC1=C(OC(=N1)C)C
InchiInChI=1S/C6H9NO/c1-4-5(2)8-6(3)7-4/h1-3H3
FormulaC6H9NO
PubChem ID30215
Molweight111.14
LogP1.5
Atoms8
Bonds0
H-bond Acceptor2
H-bond Donor0
Chemical Classificationethers nitrogen compounds oxazoles heterocyclic compounds
CHEBI-ID179309
Supernatural-IDSN0478318

Species emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
ProkaryotaCoraliitalea Coraliiisolate from the algal Chromera velia CCAP 1602/1Koteska et al. 2023
ProkaryotaBacillus Thuringiensisn/aNASchulz and Dickschat 2007
ProkaryotaBacillus Popillaen/aNASchulz and Dickschat 2007
EukaryotaSaccharomyces CerevisiaeNANAHarris et al. 2021
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
ProkaryotaCoraliitalea Coraliimarine broth agarOSSA/GC-MSno
ProkaryotaBacillus Thuringiensisn/an/ano
ProkaryotaBacillus Popillaen/an/ano
EukaryotaSaccharomyces Cerevisiaemalt extract brothHS-SPME with GC-MSno


2,4-dimethyl-1,3-oxazole

Compound Details

Synonymous names
2,4-Dimethyloxazole
7208-05-1
2,4-Dimethyl-1,3-oxazole
Oxazole, 2,4-dimethyl-
dimethyl oxazole
2,4-DIMETHYL-OXAZOLE
G0W5QQT2LD
UNII-G0W5QQT2LD
2,4-Dimethyl-1,3-oxazole #
DTXSID60222408
CHEBI:195692
MFCD00234124
AKOS006280508
CS-W011337
DB-074523
DB-243437
D3766
EN300-102560
T71266
A837415
InChI=1/C5H7NO/c1-4-3-7-5(2)6-4/h3H,1-2H
Microorganism:

Yes

IUPAC name2,4-dimethyl-1,3-oxazole
SMILESCC1=COC(=N1)C
InchiInChI=1S/C5H7NO/c1-4-3-7-5(2)6-4/h3H,1-2H3
FormulaC5H7NO
PubChem ID138961
Molweight97.12
LogP1.1
Atoms7
Bonds0
H-bond Acceptor2
H-bond Donor0
Chemical Classificationaromatic compounds azoles heterocyclic compounds nitrogen compounds oxazoles
CHEBI-ID195692
Supernatural-IDSN0294095

Species emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
ProkaryotaShewanella Algaeinhibits mycelial growth of Aspergillus flavus and germination of Aspergillus flavus' conidiasea sediment in east China coastGong et al. 2015
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
ProkaryotaShewanella AlgaeNA mediumSPME-GC/MSyes


5-benzylsulfanyl-3-phenyl-1,2-oxazole

Compound Details

Synonymous names
Isoxazole, 5-(benzylthio)-3-phenyl-
Isoxazole, 3-phenyl-5-[(phenylmethyl)thio]-
28884-17-5
CHEMBL3276988
5-(benzylthio)-3-phenylisoxazole
TZGSQRNPJUQWND-UHFFFAOYSA-N
5-(Benzylsulfanyl)-3-phenylisoxazole #
Microorganism:

No

IUPAC name5-benzylsulfanyl-3-phenyl-1,2-oxazole
SMILESC1=CC=C(C=C1)CSC2=CC(=NO2)C3=CC=CC=C3
InchiInChI=1S/C16H13NOS/c1-3-7-13(8-4-1)12-19-16-11-15(17-18-16)14-9-5-2-6-10-14/h1-11H,12H2
FormulaC16H13NOS
PubChem ID563748
Molweight267.3
LogP4.4
Atoms19
Bonds4
H-bond Acceptor3
H-bond Donor0
Chemical Classificationaromatic compounds nitrogen compounds benzenoids oxazoles sulfur compounds thioethers

mVOC Specific Details


Species emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
EukaryotaVerticillium Longisporumcollection TU GrazRybakova et al. 2017
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
EukaryotaVerticillium Longisporumpotato dextrose agar (PDA), Czapek Dox liquid cultureGC-MS / SPMEno


Ethyl 5,5-dimethyl-4H-1,3-oxazole-4-carboxylate

Compound Details

Synonymous names
KXGOYVFZXLGEMQ-UHFFFAOYSA-N
3,4-Dihydro-5,5-dimethyl-4-ethoxycarbonyloxazole
Ethyl 5,5-dimethyl-4,5-dihydro-1,3-oxazole-4-carboxylate #
Microorganism:

Yes

IUPAC nameethyl 5,5-dimethyl-4H-1,3-oxazole-4-carboxylate
SMILESCCOC(=O)C1C(OC=N1)(C)C
InchiInChI=1S/C8H13NO3/c1-4-11-7(10)6-8(2,3)12-5-9-6/h5-6H,4H2,1-3H3
FormulaC8H13NO3
PubChem ID566610
Molweight171.19
LogP0.9
Atoms12
Bonds3
H-bond Acceptor4
H-bond Donor0
Chemical Classificationaromatic compounds esters oxazoles heterocyclic compounds

mVOC Specific Details


Species emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
EukaryotaSaccharomyces CerevisiaeNANAHarris et al. 2021
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
EukaryotaSaccharomyces Cerevisiaemalt extract brothHS-SPME with GC-MSno


4-(methoxymethyl)-5-phenyl-2-(1-phenylsulfanylethyl)-4,5-dihydro-1,3-oxazole

Compound Details

Synonymous names
4-Methoxymethyl-5-phenyl-2-(1-phenylthio-ethyl)-4,5-dihydro-oxazole
UZCZQJOYFJIKRG-UHFFFAOYSA-N
Methyl (5-phenyl-2-[1-(phenylsulfanyl)ethyl]-4,5-dihydro-1,3-oxazol-4-yl)methyl ether #
Microorganism:

Yes

IUPAC name4-(methoxymethyl)-5-phenyl-2-(1-phenylsulfanylethyl)-4,5-dihydro-1,3-oxazole
SMILESCC(C1=NC(C(O1)C2=CC=CC=C2)COC)SC3=CC=CC=C3
InchiInChI=1S/C19H21NO2S/c1-14(23-16-11-7-4-8-12-16)19-20-17(13-21-2)18(22-19)15-9-5-3-6-10-15/h3-12,14,17-18H,13H2,1-2H3
FormulaC19H21NO2S
PubChem ID586174
Molweight327.4
LogP3.9
Atoms23
Bonds6
H-bond Acceptor4
H-bond Donor0
Chemical Classificationaromatic compounds benzenoids ethers heterocyclic compounds nitrogen compounds oxazoles sulfur compounds

mVOC Specific Details


Species emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
Pectobacterium CarotovorumKate et al. 2023
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
Pectobacterium Carotovoruminoculated potato samplesGC-MSno


2-[2-[(4-methyl-1,2,5-oxadiazol-3-yl)oxy]ethyl]tetrazol-5-amine

Compound Details

Synonymous names
Oprea1_346709
Oprea1_804089
OYLXPFSOFZCCQP-UHFFFAOYSA-N
HMS1692B09
2-[2-(4-Methyl-furazan-3-yloxy)-ethyl]-2H-tetrazol-5-ylamine
AKOS000609663
MCULE-2365142819
BRD-K95933661-001-01-1
Microorganism:

Yes

IUPAC name2-[2-[(4-methyl-1,2,5-oxadiazol-3-yl)oxy]ethyl]tetrazol-5-amine
SMILESCC1=NON=C1OCCN2N=C(N=N2)N
InchiInChI=1S/C6H9N7O2/c1-4-5(11-15-10-4)14-3-2-13-9-6(7)8-12-13/h2-3H2,1H3,(H2,7,9)
FormulaC6H9N7O2
PubChem ID3157632
Molweight211.18
LogP-0.1
Atoms15
Bonds4
H-bond Acceptor8
H-bond Donor1
Chemical Classificationaromatic compounds azoles amines nitrogen compounds ethers heterocyclic compounds oxazoles

mVOC Specific Details


Species emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
EukaryotaSaccharomyces CerevisiaeNANAHarris et al. 2021
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
EukaryotaSaccharomyces Cerevisiaemalt extract brothHS-SPME with GC-MSno