DOMINICALURE II

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C12H22O2
Molecular Weight	198.3019
Optical Activity	UNSPECIFIED
Defined Stereocenters	1 / 1
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CCC[C@H](C)OC(=O)C(\C)=C\C(C)C

InChI

InChIKey=FSYDYWBQQJBBIE-UQSGXBNBSA-N

InChI=1S/C12H22O2/c1-6-7-11(5)14-12(13)10(4)8-9(2)3/h8-9,11H,6-7H2,1-5H3/b10-8+/t11-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C12H22O2
Molecular Weight	198.3019
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	1 / 1
E/Z Centers	1
Optical Activity	UNSPECIFIED

Approval Year

Patents

Substance Class	Chemical Created by `admin` on `Sat Dec 16 09:21:49 GMT 2023` Edited by `admin` on `Sat Dec 16 09:21:49 GMT 2023`
Record UNII	B38FQ5R6UN
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

DOMINICALURE II

Common Name

English

2-PENTENOIC ACID, 2,4-DIMETHYL-, (1S)-1-METHYLBUTYL ESTER, (2E)-

Systematic Name

English

(E)-2,4-DIMETHYL-2-PENTENOIC ACID (S)-1-METHYLBUTYL ESTER

Systematic Name

English

2-PENTENOIC ACID, 2,4-DIMETHYL-, 1-METHYLBUTYL ESTER, (S-(E))-

Systematic Name

English

(+)-DOMINICALURE II

Systematic Name

English

Code System Code Type Description

FDA UNII

B38FQ5R6UN

Created by admin on Sat Dec 16 09:21:49 GMT 2023 , Edited by admin on Sat Dec 16 09:21:49 GMT 2023

PRIMARY

CAS

80510-16-3

Created by admin on Sat Dec 16 09:21:49 GMT 2023 , Edited by admin on Sat Dec 16 09:21:49 GMT 2023

PRIMARY

PUBCHEM

14214177

Created by admin on Sat Dec 16 09:21:49 GMT 2023 , Edited by admin on Sat Dec 16 09:21:49 GMT 2023

PRIMARY

EPA CompTox

DTXSID501337196

Created by admin on Sat Dec 16 09:21:49 GMT 2023 , Edited by admin on Sat Dec 16 09:21:49 GMT 2023

PRIMARY