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Details

Stereochemistry RACEMIC
Molecular Formula C10H20O2
Molecular Weight 172.2646
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 6-METHYL-3-HEPTYL ACETATE

SMILES

CCC(CCC(C)C)OC(C)=O

InChI

InChIKey=JMJYVXYZYYDGSN-UHFFFAOYSA-N
InChI=1S/C10H20O2/c1-5-10(12-9(4)11)7-6-8(2)3/h8,10H,5-7H2,1-4H3

HIDE SMILES / InChI

Approval Year

Unknown
149124
Name Type Language
6-METHYL-3-HEPTYL ACETATE
Systematic Name English
3-HEPTANOL, 6-METHYL-, 3-ACETATE
Preferred Name English
3-HEPTANOL, 6-METHYL-, ACETATE
Systematic Name English
6-METHYLHEPTAN-3-YL ACETATE
Systematic Name English
Code System Code Type Description
FDA UNII
NS5B428UKN
Created by admin on Wed Apr 02 11:42:46 GMT 2025 , Edited by admin on Wed Apr 02 11:42:46 GMT 2025
PRIMARY
PUBCHEM
21572653
Created by admin on Wed Apr 02 11:42:46 GMT 2025 , Edited by admin on Wed Apr 02 11:42:46 GMT 2025
PRIMARY
EPA CompTox
DTXSID30615944
Created by admin on Wed Apr 02 11:42:46 GMT 2025 , Edited by admin on Wed Apr 02 11:42:46 GMT 2025
PRIMARY
CAS
32764-34-4
Created by admin on Wed Apr 02 11:42:46 GMT 2025 , Edited by admin on Wed Apr 02 11:42:46 GMT 2025
PRIMARY
NIH
NCATS
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