Results for:
PubChem ID: 9895

2,6,6-trimethylcyclohexene-1-carbaldehyde

Mass-Spectra

Compound Details

Synonymous names
beta-Cyclocitral
432-25-7
b-cyclocitral
2,6,6-Trimethylcyclohexene-1-carbaldehyde
2,6,6-trimethylcyclohex-1-ene-1-carbaldehyde
1-Cyclohexene-1-carboxaldehyde, 2,6,6-trimethyl-
.beta.-Cyclocitral
2,6,6-TRIMETHYL-1-CYCLOHEXENE-1-CARBOXALDEHYDE
CYCLOCITRAL
2,6,6-trimethylcyclohex-1-enecarbaldehyde
alpha(beta)-Cyclocitral
2,6,6-Trimethylcyclohexenecarbaldehyde
1-Formyl-2,6,6-trimethyl-1-cyclohexene
beta -cyclocitral
Cyclohexenecarboxaldehyde, 2,6,6-trimethyl-
MFCD00079078
52844-21-0
DTXSID7047142
CHEBI:53177
2,6,6-Trimethyl-1-cyclohexen-1-carboxaldehyde
77Y0U2X29G
2,6,6-trimethyl-cyclohexene-1-carboxaldehyde
2,6,6-Trimethyl-1-cyclohexene-1-carbaldehyde
UNII-77Y0U2X29G
beta cyclocitral
beta-cyclocitrol
beta-Cyclocitral, Technical Grade
EINECS 207-081-3
AI3-37227
2,6,6-Trimethyl-1-cyclohexenecarboxaldehyde
UNII-GLL5338RMI
beta-Cyclocitral, >=95%
GLL5338RMI
CYCLOCITRAL, .BETA.-
SCHEMBL309759
b-Cyclocitral, Technical Grade
CHEMBL1952257
DTXCID5027142
?-Cyclocitral, Technical Grade
EINECS 258-219-4
Tox21_302524
beta-Cyclocitral, analytical standard
AKOS022504751
CS-W010947
HY-W010231
MCULE-7819289735
FEMA NO. 3639, .BETA.-
NCGC00256741-01
AS-56746
CAS-432-25-7
SY029933
2,6,6-Trimethyl-1-cyclohexenecarbaldehyde
2,6,6-Trimethyl-Cyclohexenecarboxaldehyde
2,6,6-trimethyl-cyclohexene-1-carbaldehyde
DB-302496
NS00013267
C20425
EN300-180215
F14917
2,6,6-Trimethyl-1-cyclohexene-1-carbaldehyde #
W-202757
Q27124011
Z1255386953
Pentadeuterio-beta-cyclocitral;1-Formyl-2,6,6-trimethyl-1-cyclohexene
InChI=1/C10H16O/c1-8-5-4-6-10(2,3)9(8)7-11/h7H,4-6H2,1-3H
Microorganism:

Yes

IUPAC name2,6,6-trimethylcyclohexene-1-carbaldehyde
SMILESCC1=C(C(CCC1)(C)C)C=O
InchiInChI=1S/C10H16O/c1-8-5-4-6-10(2,3)9(8)7-11/h7H,4-6H2,1-3H3
FormulaC10H16O
PubChem ID9895
Molweight152.23
LogP2.4
Atoms11
Bonds1
H-bond Acceptor1
H-bond Donor0
Chemical Classificationalkenes aldehydes ketones terpenoids
CHEBI-ID53177
Supernatural-IDSN0231223

Species emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
ProkaryotaCalothrix Sp.n/aNASchulz and Dickschat 2007
ProkaryotaPlectonema Sp.n/aNASchulz and Dickschat 2007
ProkaryotaCyanobacteria Sp.n/aNAHoeckelmann et al. 2004
ProkaryotaCalothrix Parietinan/aNAHoeckelmann et al. 2004
ProkaryotaPlectonema Notatumn/aNAHoeckelmann et al. 2004
ProkaryotaPlectonema Sp.n/aNAHoeckelmann et al. 2004
ProkaryotaRivularia Sp.n/aNAHoeckelmann et al. 2004
ProkaryotaRivularia Sp./Calothrix Parietinan/aNAHoeckelmann et al. 2004
ProkaryotaPhormidium Sp.n/aNAHoeckelmann et al. 2004
ProkaryotaLentilactobacillus BuchneriNANASquara et al. 2022
ProkaryotaLacticaseibacillus ParacaseiNANASquara et al. 2022
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
ProkaryotaCalothrix Sp.n/an/ano
ProkaryotaPlectonema Sp.n/an/ano
ProkaryotaCyanobacteria Sp.n/an/ano
ProkaryotaCalothrix Parietinan/an/ano
ProkaryotaPlectonema Notatumn/an/ano
ProkaryotaRivularia Sp.n/an/ano
ProkaryotaRivularia Sp./Calothrix Parietinan/an/ano
ProkaryotaPhormidium Sp.n/an/ano
ProkaryotaLentilactobacillus Buchnerimaize silageHS-SPME coupled with GC-TOF MSno
ProkaryotaLacticaseibacillus Paracaseimaize silageHS-SPME coupled with GC-TOF MSno