2-Methyl-4-oxo-4H-pyran-3-yl 3-methyl-2-butenoate

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C11H12O4
Molecular Weight	208.2106
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 3-methyl-2-butenoate

Structure Search

SMILES

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

InChI

InChIKey=RGFWHIQAWJMOBE-UHFFFAOYSA-N

InChI=1S/C11H12O4/c1-7(2)6-10(13)15-11-8(3)14-5-4-9(11)12/h4-6H,1-3H3

HIDE SMILES / InChI

Molecular Formula	C11H12O4
Molecular Weight	208.2106
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 12:16:52 GMT 2023` Edited by `admin` on `Sat Dec 16 12:16:52 GMT 2023`
Record UNII	WM92N3PY7D
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

2-Methyl-4-oxo-4H-pyran-3-yl 3-methyl-2-butenoate

Systematic Name

English

2-Butenoic acid, 3-methyl-, 2-methyl-4-oxo-4H-pyran-3-yl ester

Systematic Name

English

Code System Code Type Description

ECHA (EC/EINECS)

299-847-9

Created by admin on Sat Dec 16 12:16:52 GMT 2023 , Edited by admin on Sat Dec 16 12:16:52 GMT 2023

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CAS

93917-69-2

Created by admin on Sat Dec 16 12:16:52 GMT 2023 , Edited by admin on Sat Dec 16 12:16:52 GMT 2023

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FDA UNII

WM92N3PY7D

Created by admin on Sat Dec 16 12:16:52 GMT 2023 , Edited by admin on Sat Dec 16 12:16:52 GMT 2023

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PUBCHEM

16205864

Created by admin on Sat Dec 16 12:16:52 GMT 2023 , Edited by admin on Sat Dec 16 12:16:52 GMT 2023

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EPA CompTox

DTXSID90239882

Created by admin on Sat Dec 16 12:16:52 GMT 2023 , Edited by admin on Sat Dec 16 12:16:52 GMT 2023

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