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CAS Number: 55186-89-5
1-benzyl-1,4-diazepan-5-one

Structure

1-benzyl-1,4-diazepan-5-one
Name: 1-benzyl-1,4-diazepan-5-one
Synonyms:
General Information
Product Number: 55186895

CAS Registry Number 55186-89-5
Name:
5H-​1,​4-​Diazepin-​5-​one, hexahydro-​1-​(phenylmethyl)​-
1-Benzyl-1,4-diazepan-5-one
1-Benzyl-1,4-diazepin-5-one
NSC 45105

 

Chemical Formula: C12H16N2O
Exact Mass: 204.13
Molecular Weight: 204.27
m/z: 204.13 (100.0%), 205.13 (13.2%), 206.13 (1.1%)

 

InChI:InChI=1S/C12H16N2O/c15-12-6-8-14(9-7-13-12)10-11-4-2-1-3-5-11/h1-5H,6-10H2,(H,13,15)

InChI Key:DKNOPZCYIDBMNY-UHFFFAOYSA-N

Canonical SMILES:C1CN(CCNC1=O)CC2=CC=CC=C2

Specification

98%

References

(1) Sha, Fei; Acta Crystallographica, Section E: Structure Reports Online 2008, V64(3), Po569, o569/1-o569/7 CAPLUS

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