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CAS Number: 103146-25-4
3-(hydroxymethyl)benzonitrile

Structure

 3-(hydroxymethyl)benzonitrile
Name: 3-(hydroxymethyl)benzonitrile
Synonyms:
General Information
Product Number: 103146254

CAS Registry Number 103146-25-4
Name:
Benzonitrile, 4-?[4-?(dimethylamino)?-?1-?(4-?fluorophenyl)?-?1-?hydroxybutyl]?-?3-?(hydroxymethyl)?-
4-[4-(Dimethylamino)-1-(4-fluorophenyl)-1-hydroxybutyl]-3-(hydroxymethyl)benzonitrile
4-[4-(Dimethylamino)-1-(4'-fluorophenyl)-1-[hydroxy]butyl]-3-(hydroxymethyl)benzonitrile
Citadiol

 

Chemical Formula: C8H7NO
Exact Mass: 133.05
Molecular Weight: 133.15
m/z: 133.05 (100.0%), 134.06 (8.8%)

 

InChI:InChI=1S/C20H23FN2O2/c1-23(2)11-3-10-20(25,17-5-7-18(21)8-6-17)19-9-4-15(13-22)12-16(19)14-24/h4-9,12,24-25H,3,10-11,14H2,1-2H3

InChI Key:GNULRNVWXYXBQY-UHFFFAOYSA-N

Canonical SMILES:CN(C)CCCC(C1=CC=C(C=C1)F)(C2=C(C=C(C=C2)C#N)CO)O

Specification

98%
References
  1. (2) Gu, Jian Ming; Acta Crystallographica, Section E: Structure Reports Online 2005, V61(8), Po2691-o2693 CAPLUS
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