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CHEBI:143870 - ethyl vanillin isobutyrate
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ChEBI Name
ethyl vanillin isobutyrate
ChEBI ID
CHEBI:143870
Definition
A member of the class of benzaldehydes that is benzaldehyde substituted by an ethoxy group at position 3 and by a (2-methylpropanoyl)oxy group at position 4.
Stars
This entity has been manually annotated by the ChEBI Team.
Submitter
Mark Williams
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Formula
C13H16O4
Net Charge
0
Average Mass
236.267
Monoisotopic Mass
236.10486
InChI
InChI=1S/C13H16O4/c1-4-16-12-7-10(8-14)5-6-11(12)17-13(15)9(2)3/h5-9H,4H2,1-3H3
InChIKey
BTCQMCOBMIXUCG-UHFFFAOYSA-N
SMILES
O(C(=O)C(C)C)C1=C(OCC)C=C(C=C1)C([H])=O
Roles Classification
Biological Role
(s):
flavouring agent
A food additive that is used to added improve the taste or odour of a food.
Application
(s):
flavouring agent
A food additive that is used to added improve the taste or odour of a food.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
ethyl vanillin isobutyrate (
CHEBI:143870
)
has role
flavouring agent (
CHEBI:35617
)
ethyl vanillin isobutyrate (
CHEBI:143870
)
is a
aromatic ether (
CHEBI:35618
)
ethyl vanillin isobutyrate (
CHEBI:143870
)
is a
benzaldehydes (
CHEBI:22698
)
ethyl vanillin isobutyrate (
CHEBI:143870
)
is a
carboxylic ester (
CHEBI:33308
)
IUPAC Name
2-ethoxy-4-formylphenyl 2-methylpropanoate
Synonyms
Sources
2-ethoxy-4-formylphenyl isobutyrate
ChemIDplus
2-methylpropanoic acid 2-ethoxy-4-formylphenyl ester
ChEBI
4-isobutanoyloxy-3-ethoxybenzaldehyde
ChemIDplus
ethyl vanillin isobutyrate
ChemIDplus
Manual Xrefs
Databases
FDB016810
FooDB
HMDB0037683
HMDB
View more database links
Registry Number
Type
Source
188417-26-7
CAS Registry Number
ChemIDplus
Last Modified
11 June 2019