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Details

Stereochemistry ABSOLUTE
Molecular Formula C7H12O
Molecular Weight 112.1696
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2,3-Dimethyl-4-pentenal, (2S,3R)-

SMILES

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

InChI

InChIKey=HXPMOQYQMCGITO-RNFRBKRXSA-N
InChI=1S/C7H12O/c1-4-6(2)7(3)5-8/h4-7H,1H2,2-3H3/t6-,7-/m1/s1

HIDE SMILES / InChI

Approval Year

Unknown
149124
Name Type Language
2,3-Dimethyl-4-pentenal, (2S,3R)-
Systematic Name English
(2S,3R)-2,3-Dimethyl-4-pentenal
Preferred Name English
(2S,3R)-2,3-Dimethylpent-4-enal
Systematic Name English
4-Pentenal, 2,3-dimethyl-, (2S,3R)-
Systematic Name English
Code System Code Type Description
PUBCHEM
130641966
Created by admin on Tue Apr 01 16:56:40 GMT 2025 , Edited by admin on Tue Apr 01 16:56:40 GMT 2025
PRIMARY
FDA UNII
K5H2KW8VZQ
Created by admin on Tue Apr 01 16:56:40 GMT 2025 , Edited by admin on Tue Apr 01 16:56:40 GMT 2025
PRIMARY
CAS
1931926-79-2
Created by admin on Tue Apr 01 16:56:40 GMT 2025 , Edited by admin on Tue Apr 01 16:56:40 GMT 2025
PRIMARY
NIH
NCATS
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