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PubChem ID: 11903
1-ethyl-2-methylbenzene
Mass-Spectra
Compound Details
Synonymous names
Ethyltoluene
o-Methylethylbenzene
o-Ethylmethylbenzene
HYFLWBNQFMXCPA-UHFFFAOYSA-N
ortho-Ethyltoluene
2-Methylethylbenzene
2-ethylmethylbenzene
Ethyl toluene
O-ETHYLTOLUENE
o-Ethyl methylbenzene
2-Ethyltoluene
AC1L1YEC
o-Ethyl methyl benzene
1,2-methylethylbenzene
ACMC-1AZ6D
KSC202O8L
2-ethyl-1-methylbenzene
2-Methyl-1-ethylbenzene
1-Methyl-2-ethylbenzene
1-Ethyl-2-methylbenzene
DBX00873SV
CTK1A2785
E0184
Z4941
ACT08587
RL04305
CHEMBL364233
VZ36658
Toluene, ar-ethyl-
BIDD:ER0573
C14572
Toluene, o-ethyl-
UNII-DBX00873SV
OR012325
1-ethyl-2-methyl-benzene
DS-2369
DTXSID2050403
NSC405731
AN-9508
SBB061450
AC-6953
OR131941
M-3915
Toluene, 2-ethyl-
ZINC1598717
2-Ethyltoluene, 99%
CHEBI:34276
CJ-25677
ST2408766
SC-85189
AJ-27913
AK-49977
AN-17782
ANW-75613
AX8074745
KB-12102
DSSTox_GSID_50403
FCH1115636
CC-10546
DSSTox_CID_29477
ZINC01598717
2-Ethyltoluene, certified reference material, TraceCERT(R)
BDBM50167949
MFCD00009257
WLN: 2R B1
C-24754
TC-020732
ST51047463
RTC-020732
AI3-28773
AM20040851
DB-024735
NSC-405731
NSC 405731
LS-154071
AKOS015842902
J-504600
I01-7268
FT-0603747
4CH-015163
BRN 1851237
Tox21_303797
Benzene, 1-ethyl-2-methyl-
611-14-3
NCGC00356979-01
MCULE-7161910991
EINECS 210-255-1
EINECS 247-093-6
CAS-611-14-3
25154-47-6
MolPort-003-925-441
15402-EP2316837A1
15402-EP2314589A1
15402-EP2311839A1
15402-EP2305683A1
4-05-00-00999 (Beilstein Handbook Reference)
InChI=1/C9H12/c1-3-9-7-5-4-6-8(9)2/h4-7H,3H2,1-2H
Microorganism:
Yes
IUPAC name
1-ethyl-2-methylbenzene
SMILES
CCC1=CC=CC=C1C
Inchi
InChI=1S/C9H12/c1-3-9-7-5-4-6-8(9)2/h4-7H,3H2,1-2H3
Formula
C
9
H
1
2
PubChem ID
11903
Molweight
120.195
LogP
3.44
Atoms
21
Bonds
21
H-bond Acceptor
0
H-bond Donor
0
Chemical Classification
alkylbenzenes
benzenoids
mVOC Specific Details
MS-Links
MS-MS Spectrum 63746
MS-MS Spectrum 120743
MS-MS Spectrum 120742
MS-MS Spectrum 63744
MS-MS Spectrum 120741
MS-MS Spectrum 63745
1D-NMR-Links
1D NMR Spectrum 4632
1D NMR Spectrum 4506
Microorganisms emitting the compound
Kingdom
Species
Biological Function
Origin/Habitat
Reference
Bacteria
Clostridium Difficile
outbreak 2006 UK
Rees et al 2016
Fungi
Aspergillus Candidus
compost
Fischer et al. 2059
Fungi
Fusarium Graminearum 15AcDON
n/a
Busko et al., 2014
Fungi
Fusarium Graminearum 15AcDON 1001ta
n/a
Busko et al., 2014
Fungi
Fusarium Graminearum 15AcDON ZFR 29
n/a
Busko et al., 2014
Fungi
Fusarium Graminearum 15AcDON_4
n/a
Busko et al., 2014
Fungi
Fusarium Graminearum 15AcDON_5
n/a
Busko et al., 2014
Fungi
Fusarium Graminearum 15AcDON_6
n/a
Busko et al., 2014
Fungi
Fusarium Graminearum 15AcDON_7
n/a
Busko et al., 2014
Fungi
Fusarium Graminearum 15AcDON_8
n/a
Busko et al., 2014
Fungi
Fusarium Graminearum 15AcDON_9
n/a
Busko et al., 2014
Fungi
Fusarium Graminearum 3AcDON 1002t
n/a
Busko et al., 2014
Fungi
Fusarium Graminearum 3AcDON 11791
n/a
Busko et al., 2014
Fungi
Fusarium Graminearum 3AcDON 1509
n/a
Busko et al., 2014
Fungi
Fusarium Graminearum 3AcDON 8046
n/a
Busko et al., 2014
Fungi
Fusarium Graminearum 3AcDON NRRL38369
n/a
Busko et al., 2014
Fungi
Fusarium Graminearum 3AcDON NRRL6394
n/a
Busko et al., 2014
Fungi
Fusarium Graminearum 3AcDON ZFR 15
n/a
Busko et al., 2014
Fungi
Fusarium Graminearum 3AcDON ZFR 37
n/a
Busko et al., 2014
Fungi
Fusarium Graminearum 3AcDON ZFR 51
n/a
Busko et al., 2014
Fungi
Fusarium Graminearum NIV
n/a
Busko et al., 2014
Fungi
Fusarium Graminearum NIV 357
n/a
Busko et al., 2014
Fungi
Fusarium Graminearum NIV ZFR 119
n/a
Busko et al., 2014
Fungi
Fusarium Graminearum NIV ZFR 23
n/a
Busko et al., 2014
Fungi
Fusarium Graminearum NIV ZFR 48
n/a
Busko et al., 2014
Fungi
Fusarium Graminearum NIV_5
n/a
Busko et al., 2014
Fungi
Fusarium Graminearum NIV_6
n/a
Busko et al., 2014
Fungi
Fusarium Graminearum NIV_7
n/a
Busko et al., 2014
Fungi
Fusarium Graminearum NIV_8
n/a
Busko et al., 2014
Method
Kingdom
Species
Growth Medium
Applied Method
Verification
Bacteria
Clostridium Difficile
brain heart infusion
GCxGC-TOF-MS
yes
Fungi
Aspergillus Candidus
yest extract sucrose
Tenax/GC-MS
no
Fungi
Fusarium Graminearum 15AcDON
yeast extract sucrose agar
SPME/GC-MS
Fungi
Fusarium Graminearum 15AcDON 1001ta
yeast extract sucrose agar
SPME/GC-MS
Fungi
Fusarium Graminearum 15AcDON ZFR 29
yeast extract sucrose agar
SPME/GC-MS
Fungi
Fusarium Graminearum 15AcDON_4
yeast extract sucrose agar
SPME/GC-MS
Fungi
Fusarium Graminearum 15AcDON_5
yeast extract sucrose agar
SPME/GC-MS
Fungi
Fusarium Graminearum 15AcDON_6
yeast extract sucrose agar
SPME/GC-MS
Fungi
Fusarium Graminearum 15AcDON_7
yeast extract sucrose agar
SPME/GC-MS
Fungi
Fusarium Graminearum 15AcDON_8
yeast extract sucrose agar
SPME/GC-MS
Fungi
Fusarium Graminearum 15AcDON_9
yeast extract sucrose agar
SPME/GC-MS
Fungi
Fusarium Graminearum 3AcDON 1002t
yeast extract sucrose agar
SPME/GC-MS
Fungi
Fusarium Graminearum 3AcDON 11791
yeast extract sucrose agar
SPME/GC-MS
Fungi
Fusarium Graminearum 3AcDON 1509
yeast extract sucrose agar
SPME/GC-MS
Fungi
Fusarium Graminearum 3AcDON 8046
yeast extract sucrose agar
SPME/GC-MS
Fungi
Fusarium Graminearum 3AcDON NRRL38369
yeast extract sucrose agar
SPME/GC-MS
Fungi
Fusarium Graminearum 3AcDON NRRL6394
yeast extract sucrose agar
SPME/GC-MS
Fungi
Fusarium Graminearum 3AcDON ZFR 15
yeast extract sucrose agar
SPME/GC-MS
Fungi
Fusarium Graminearum 3AcDON ZFR 37
yeast extract sucrose agar
SPME/GC-MS
Fungi
Fusarium Graminearum 3AcDON ZFR 51
yeast extract sucrose agar
SPME/GC-MS
Fungi
Fusarium Graminearum NIV
yeast extract sucrose agar
SPME/GC-MS
Fungi
Fusarium Graminearum NIV 357
yeast extract sucrose agar
SPME/GC-MS
Fungi
Fusarium Graminearum NIV ZFR 119
yeast extract sucrose agar
SPME/GC-MS
Fungi
Fusarium Graminearum NIV ZFR 23
yeast extract sucrose agar
SPME/GC-MS
Fungi
Fusarium Graminearum NIV ZFR 48
yeast extract sucrose agar
SPME/GC-MS
Fungi
Fusarium Graminearum NIV_5
yeast extract sucrose agar
SPME/GC-MS
Fungi
Fusarium Graminearum NIV_6
yeast extract sucrose agar
SPME/GC-MS
Fungi
Fusarium Graminearum NIV_7
yeast extract sucrose agar
SPME/GC-MS
Fungi
Fusarium Graminearum NIV_8
yeast extract sucrose agar
SPME/GC-MS