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Details

Stereochemistry ABSOLUTE
Molecular Formula C6H12O
Molecular Weight 100.1589
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-Methyl-2-pentanone, (3S)-

SMILES

CC[C@H](C)C(C)=O

InChI

InChIKey=UIHCLUNTQKBZGK-YFKPBYRVSA-N
InChI=1S/C6H12O/c1-4-5(2)6(3)7/h5H,4H2,1-3H3/t5-/m0/s1

HIDE SMILES / InChI

Approval Year

Unknown
149124
Name Type Language
3-Methyl-2-pentanone, (3S)-
Systematic Name English
(+)-3-Methyl-2-pentanone
Preferred Name English
(3S)-3-Methyl-2-pentanone
Systematic Name English
(3S)-3-Methylpentan-2-one
Systematic Name English
2-Pentanone, 3-methyl-, (S)-(+)
Systematic Name English
2-Pentanone, 3-methyl-, (3S)-
Systematic Name English
Code System Code Type Description
PUBCHEM
6994393
Created by admin on Wed Apr 02 20:31:21 GMT 2025 , Edited by admin on Wed Apr 02 20:31:21 GMT 2025
PRIMARY
FDA UNII
LNJ8A7YP25
Created by admin on Wed Apr 02 20:31:21 GMT 2025 , Edited by admin on Wed Apr 02 20:31:21 GMT 2025
PRIMARY
CAS
2695-53-6
Created by admin on Wed Apr 02 20:31:21 GMT 2025 , Edited by admin on Wed Apr 02 20:31:21 GMT 2025
PRIMARY
NIH
NCATS
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