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InChI=1S/CH4O/c1-2/h2H,1H3
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ChEBI
> Main
CHEBI:15565 - (1
S
,2
R
)-3-methylcyclohexa-3,5-diene-1,2-diol
Main
ChEBI Ontology
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ChEBI Name
(1
S
,2
R
)-3-methylcyclohexa-3,5-diene-1,2-diol
ChEBI ID
CHEBI:15565
ChEBI ASCII Name
(1S,2R)-3-methylcyclohexa-3,5-diene-1,2-diol
Stars
This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs
CHEBI:9626, CHEBI:10829, CHEBI:18512
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Formula
C7H10O2
Net Charge
0
Average Mass
126.15310
Monoisotopic Mass
126.06808
InChI
InChI=1S/C7H10O2/c1-5-3-2-4-6(8)7(5)9/h2-4,6-9H,1H3/t6-,7+/m0/s1
InChIKey
FTZZKLFGNQOODA-NKWVEPMBSA-N
SMILES
CC1=CC=C[C@H](O)[C@@H]1O
ChEBI Ontology
Outgoing
(1
S
,2
R
)-3-methylcyclohexa-3,5-diene-1,2-diol (
CHEBI:15565
)
is a
cyclohexadienediol (
CHEBI:23469
)
IUPAC Name
(1
S
,2
R
)-3-methylcyclohexa-3,5-diene-1,2-diol
Synonyms
Sources
(1S,2R)-3-methylcyclohexa-3,5-diene-1,2-diol
ChEBI
(1S,2R)-3-Methylcyclohexa-3,5-diene-1,2-diol
KEGG COMPOUND
(1
S
,2
R
)-3-methylcyclohexa-3,5-diene-1,2-diol
UniProt
Toluene-
cis
-1,2-dihydrodiol
Note: (2005-03-10) Erroneous name. Alternative might be Toluene-cis-2,3-dihydrodiol.
UM-BBD
Toluene-cis-dihydrodiol
KEGG COMPOUND
Manual Xrefs
Databases
c0283
UM-BBD
C04592
KEGG COMPOUND
View more database links
Registry Number
Type
Source
41977-20-2
CAS Registry Number
UM-BBD
Last Modified
04 August 2015