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CAS Number: 50683-32-4
1-bromoisochroman

Structure

 1-bromoisochroman
Name: 1-bromoisochroman
Synonyms:
General Information
Product Number: 50683324

CAS Registry Number 50683-32-4
Name:
1H-?2-?Benzopyran, 1-?bromo-?3,?4-?dihydro-
Isochroman, 1-bromo- (6CI)
1-Bromoisochroman

 

Chemical Formula: C9H9BrO
Exact Mass: 211.98
Molecular Weight: 213.07
m/z: 211.98 (100.0%), 213.98 (97.3%), 212.99 (9.9%), 214.98 (9.5%)

 

InChI:InChI=1S/C9H9BrO/c10-9-8-4-2-1-3-7(8)5-6-11-9/h1-4,9H,5-6H2

InChI Key:OYHBXVUMVBUXLZ-UHFFFAOYSA-N

Canonical SMILES:C1COC(C2=CC=CC=C21)Br

Specification

98%
References
  1. (1) Samodurova, A. G.; Sintezy Geterotsiklicheskikh Soedinenii 1981, V12, P63-4 CAPLUS
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