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CAS Number: 182949-89-9
5-bromoisochroman

Structure

5-bromoisochroman
Name: 5-bromoisochroman
Synonyms:
General Information
Product Number: 182949899

CAS Registry Number 182949-89-9
Name:
1H-?2-?Benzopyran, 5-?bromo-?3,?4-?dihydro-

 

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/c10-9-3-1-2-7-6-11-5-4-8(7)9/h1-3H,4-6H2

InChI Key:HDHXNQYPFLNOOP-UHFFFAOYSA-N

Canonical SMILES:C1COCC2=C1C(=CC=C2)Br

Specification

98%

References

(1) Favor, David A.; Tetrahedron Letters 2007, V48(17), P3039-3041 CAPLUS

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