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Details

Stereochemistry ABSOLUTE
Molecular Formula C11H14O
Molecular Weight 162.2283
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-METHYL-4-PHENYLBUTYRALDEHYDE, (-)-

SMILES

C[C@H](CC=O)CC1=CC=CC=C1

InChI

InChIKey=GNQAZNILNLQRJV-SNVBAGLBSA-N
InChI=1S/C11H14O/c1-10(7-8-12)9-11-5-3-2-4-6-11/h2-6,8,10H,7,9H2,1H3/t10-/m1/s1

HIDE SMILES / InChI

Molecular Formula C11H14O
Molecular Weight 162.2283
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 10:26:16 GMT 2023
Edited
by admin
on Sat Dec 16 10:26:16 GMT 2023
Record UNII
U15H44361Z
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-METHYL-4-PHENYLBUTYRALDEHYDE, (-)-
Systematic Name English
3-METHYL-4-PHENYLBUTYRALDEHYDE, (S)-
Systematic Name English
BENZENEBUTANAL, .BETA.-METHYL-, (.BETA.S)-
Systematic Name English
Code System Code Type Description
PUBCHEM
91826973
Created by admin on Sat Dec 16 10:26:16 GMT 2023 , Edited by admin on Sat Dec 16 10:26:16 GMT 2023
PRIMARY
FDA UNII
U15H44361Z
Created by admin on Sat Dec 16 10:26:16 GMT 2023 , Edited by admin on Sat Dec 16 10:26:16 GMT 2023
PRIMARY
CAS
637330-82-6
Created by admin on Sat Dec 16 10:26:16 GMT 2023 , Edited by admin on Sat Dec 16 10:26:16 GMT 2023
PRIMARY
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