7-METHOXY-3,7-DIMETHYLOCTANAL

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NCATS

Details

Stereochemistry	RACEMIC
Molecular Formula	C11H22O2
Molecular Weight	186.2912
Optical Activity	( + / - )
Defined Stereocenters	0 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 7-METHOXY-3,7-DIMETHYLOCTANAL

Structure Search

SMILES

COC(C)(C)CCCC(C)CC=O

InChI

InChIKey=IDWULKZGRNHZNR-UHFFFAOYSA-N

InChI=1S/C11H22O2/c1-10(7-9-12)6-5-8-11(2,3)13-4/h9-10H,5-8H2,1-4H3

HIDE SMILES / InChI

Molecular Formula	C11H22O2
Molecular Weight	186.2912
Charge	0
Count

Stereochemistry	RACEMIC
Additional Stereochemistry	No
Defined Stereocenters	0 / 1
E/Z Centers	0
Optical Activity	( + / - )

Approval Year

Substance Class	Chemical Created by `admin` on `Mon Mar 31 22:20:03 GMT 2025` Edited by `admin` on `Mon Mar 31 22:20:03 GMT 2025`
Record UNII	261VCL42SZ
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

7-METHOXY-3,7-DIMETHYLOCTANAL

Systematic Name

English

J8.182E

Preferred Name

English

7-METHOXY-3,7-DIMETHYL-1-OCTANAL

Systematic Name

English

7-METHOXYCITRONELLAL

Common Name

English

OCTANAL, 7-METHOXY-3,7-DIMETHYL-

Systematic Name

English

7-METHOXY-6,7-DIHYDROCITRONELLAL

Common Name

English

Code System Code Type Description

EPA CompTox

DTXSID7038818

Created by admin on Mon Mar 31 22:20:03 GMT 2025 , Edited by admin on Mon Mar 31 22:20:03 GMT 2025

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CAS

3613-30-7

Created by admin on Mon Mar 31 22:20:03 GMT 2025 , Edited by admin on Mon Mar 31 22:20:03 GMT 2025

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PUBCHEM

19223

Created by admin on Mon Mar 31 22:20:03 GMT 2025 , Edited by admin on Mon Mar 31 22:20:03 GMT 2025

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FDA UNII

261VCL42SZ

Created by admin on Mon Mar 31 22:20:03 GMT 2025 , Edited by admin on Mon Mar 31 22:20:03 GMT 2025

PRIMARY

ECHA (EC/EINECS)

222-784-5

Created by admin on Mon Mar 31 22:20:03 GMT 2025 , Edited by admin on Mon Mar 31 22:20:03 GMT 2025

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