U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow 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

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

Approval Year

Name Type Language
7-METHOXY-3,7-DIMETHYLOCTANAL
Systematic Name English
7-METHOXY-3,7-DIMETHYL-1-OCTANAL
Systematic Name English
7-METHOXYCITRONELLAL
Common Name English
J8.182E
Code 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 Sat Dec 16 08:50:13 GMT 2023 , Edited by admin on Sat Dec 16 08:50:13 GMT 2023
PRIMARY
CAS
3613-30-7
Created by admin on Sat Dec 16 08:50:13 GMT 2023 , Edited by admin on Sat Dec 16 08:50:13 GMT 2023
PRIMARY
PUBCHEM
19223
Created by admin on Sat Dec 16 08:50:13 GMT 2023 , Edited by admin on Sat Dec 16 08:50:13 GMT 2023
PRIMARY
FDA UNII
261VCL42SZ
Created by admin on Sat Dec 16 08:50:13 GMT 2023 , Edited by admin on Sat Dec 16 08:50:13 GMT 2023
PRIMARY
ECHA (EC/EINECS)
222-784-5
Created by admin on Sat Dec 16 08:50:13 GMT 2023 , Edited by admin on Sat Dec 16 08:50:13 GMT 2023
PRIMARY