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InChI=1S/CH4O/c1-2/h2H,1H3
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CHEBI:20110 - 3-methylsalicylaldehyde
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ChEBI Name
3-methylsalicylaldehyde
ChEBI ID
CHEBI:20110
Definition
A member of the class of benzaldehydes that is salicylaldehyde in which the hydrogen
ortho
- to the hydroxy group is substituted by a methyl group.
Stars
This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs
CHEBI:34343
Supplier Information
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Molfile
Formula
C8H8O2
Net Charge
0
Average Mass
136.14790
Monoisotopic Mass
136.05243
InChI
InChI=1S/C8H8O2/c1-6-3-2-4-7(5-9)8(6)10/h2-5,10H,1H3
InChIKey
IPPQNXSAJZOTJZ-UHFFFAOYSA-N
SMILES
[H]C(=O)c1cccc(C)c1O
ChEBI Ontology
Outgoing
3-methylsalicylaldehyde (
CHEBI:20110
)
has functional parent
salicylaldehyde (
CHEBI:16008
)
3-methylsalicylaldehyde (
CHEBI:20110
)
is a
benzaldehydes (
CHEBI:22698
)
3-methylsalicylaldehyde (
CHEBI:20110
)
is a
phenols (
CHEBI:33853
)
IUPAC Name
2-hydroxy-3-methylbenzaldehyde
Synonyms
Sources
3-methyl-2-hydroxybenzaldehyde
ChEBI
3-methylsalicylic aldehyde
ChEBI
Manual Xrefs
Databases
c0718
UM-BBD
C14087
KEGG COMPOUND
CN101851225
Patent
View more database links
Registry Numbers
Types
Sources
1099377
Beilstein Registry Number
Beilstein
1099377
Reaxys Registry Number
Reaxys
824-42-0
CAS Registry Number
KEGG COMPOUND
824-42-0
CAS Registry Number
UM-BBD
Citation
Type
Source
21222144
PubMed citation
Europe PMC
Last Modified
16 July 2015