2-METHYL-4-OXO-4H-PYRAN-3-YL ISOVALERATE

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C11H14O4
Molecular Weight	210.2265
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 2-METHYL-4-OXO-4H-PYRAN-3-YL ISOVALERATE

Structure Search

SMILES

CC(C)CC(=O)OC1=C(C)OC=CC1=O

InChI

InChIKey=RUJFQPWLSZMPNC-UHFFFAOYSA-N

InChI=1S/C11H14O4/c1-7(2)6-10(13)15-11-8(3)14-5-4-9(11)12/h4-5,7H,6H2,1-3H3

HIDE SMILES / InChI

Molecular Formula	C11H14O4
Molecular Weight	210.2265
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 12:25:40 GMT 2023` Edited by `admin` on `Sat Dec 16 12:25:40 GMT 2023`
Record UNII	2Y4CE24UYS
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

2-METHYL-4-OXO-4H-PYRAN-3-YL ISOVALERATE

Systematic Name

English

BUTANOIC ACID, 3-METHYL-, 2-METHYL-4-OXO-4H-PYRAN-3-YL ESTER

Systematic Name

English

2-METHYL-4-OXO-4H-PYRAN-3-YL 3-METHYLBUTANOATE

Systematic Name

English

Code System Code Type Description

PUBCHEM

16205937

Created by admin on Sat Dec 16 12:25:40 GMT 2023 , Edited by admin on Sat Dec 16 12:25:40 GMT 2023

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CAS

94021-97-3

Created by admin on Sat Dec 16 12:25:40 GMT 2023 , Edited by admin on Sat Dec 16 12:25:40 GMT 2023

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FDA UNII

2Y4CE24UYS

Created by admin on Sat Dec 16 12:25:40 GMT 2023 , Edited by admin on Sat Dec 16 12:25:40 GMT 2023

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EPA CompTox

DTXSID10240253

Created by admin on Sat Dec 16 12:25:40 GMT 2023 , Edited by admin on Sat Dec 16 12:25:40 GMT 2023

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ECHA (EC/EINECS)

301-489-6

Created by admin on Sat Dec 16 12:25:40 GMT 2023 , Edited by admin on Sat Dec 16 12:25:40 GMT 2023

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