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CAS Number: 50396-63-9
6-fluoroisochroman

Structure

 6-fluoroisochroman
Name: 6-fluoroisochroman
Synonyms:
General Information
Product Number: 50396639

CAS Registry Number 50396-63-9
Name:
1H-?2-?Benzopyran, 6-?fluoro-?3,?4-?dihydro-
6-Fluoroisochroman

 

Chemical Formula: C9H9FO
Exact Mass: 152.06
Molecular Weight: 152.17
m/z: 152.06 (100.0%), 153.07 (9.9%)

 

InChI:InChI=1S/C9H9FO/c10-9-2-1-8-6-11-4-3-7(8)5-9/h1-2,5H,3-4,6H2

InChI Key:KUSSTKTZJFPGBJ-UHFFFAOYSA-N

Canonical SMILES:C1COCC2=C1C=C(C=C2)F

Specification

98%
References
  1. (3) Reisman, Sarah E.; Journal of the American Chemical Society 2008, V130(23), P7198-7199 CAPLUS
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