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CAS Number: 21413-75-2
1-chloro-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-one

Structure

 1-chloro-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-one
Name: 1-chloro-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-one
Synonyms:
General Information
Product Number: 21413752

CAS Registry Number 21413-75-2
Name:
5H-?Benzocyclohepten-?5-?one, 1-?chloro-?6,?7,?8,?9-?tetrahydro-
1-Chlorobenzosuberone

 

Chemical Formula: C11H11ClO
Exact Mass: 194.05
Molecular Weight: 194.66
m/z: 194.05 (100.0%), 196.05 (32.2%), 195.05 (11.9%), 197.05 (3.9%)

 

InChI:InChI=1S/C11H11ClO/c12-10-6-3-5-9-8(10)4-1-2-7-11(9)13/h3,5-6H,1-2,4,7H2

InChI Key:CUAFENGORRFMLB-UHFFFAOYSA-N

Canonical SMILES:C1CCC(=O)C2=C(C1)C(=CC=C2)Cl

Specification

98%
References
  1. (1) Galantay, Eugene E.; US 3442903 A 1969 CAPLUS
  2. (2) Galantay, Eugene E.; US 3408360 A 1968 CAPLUS
  3. (3) Galantay, Eugene E.; US 3458522 A 1969 CAPLUS
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