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Details

Stereochemistry ABSOLUTE
Molecular Formula C8H7NO
Molecular Weight 133.1473
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of MANDELONITRILE, (-)-

SMILES

O[C@H](C#N)C1=CC=CC=C1

InChI

InChIKey=NNICRUQPODTGRU-MRVPVSSYSA-N
InChI=1S/C8H7NO/c9-6-8(10)7-4-2-1-3-5-7/h1-5,8,10H/t8-/m1/s1

HIDE SMILES / InChI

Molecular Formula C8H7NO
Molecular Weight 133.1473
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

PubMed

PubMed

TitleDatePubMed
Patents

Patents

Substance Class Chemical
Created
by admin
on Sat Dec 16 09:29:34 GMT 2023
Edited
by admin
on Sat Dec 16 09:29:34 GMT 2023
Record UNII
2K9VO6WZ5K
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
MANDELONITRILE, (-)-
Common Name English
(S)-BENZALDEHYDE CYANOHYDRIN
Common Name English
(-)-MANDELONITRILE
Systematic Name English
MANDELONITRILE, L-
Common Name English
BENZENEACETONITRILE, .ALPHA.-HYDROXY-, (.ALPHA.S)-
Systematic Name English
(S)-2-HYDROXY-2-PHENYLACETONITRILE
Systematic Name English
(S)-(-)-2-HYDROXY-2-PHENYLACETONITRILE
Systematic Name English
(S)-(-)-MANDELONITRILE
Common Name English
Code System Code Type Description
FDA UNII
2K9VO6WZ5K
Created by admin on Sat Dec 16 09:29:34 GMT 2023 , Edited by admin on Sat Dec 16 09:29:34 GMT 2023
PRIMARY
CHEBI
36941
Created by admin on Sat Dec 16 09:29:34 GMT 2023 , Edited by admin on Sat Dec 16 09:29:34 GMT 2023
PRIMARY
CAS
28549-12-4
Created by admin on Sat Dec 16 09:29:34 GMT 2023 , Edited by admin on Sat Dec 16 09:29:34 GMT 2023
PRIMARY
DRUG BANK
DB04737
Created by admin on Sat Dec 16 09:29:34 GMT 2023 , Edited by admin on Sat Dec 16 09:29:34 GMT 2023
PRIMARY
PUBCHEM
439767
Created by admin on Sat Dec 16 09:29:34 GMT 2023 , Edited by admin on Sat Dec 16 09:29:34 GMT 2023
PRIMARY