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CAS Number: 864262-77-1
1-(9-bromo-6-hydroxy-2,3,4,5-tetrahydro-1H-benzo[d]azepin-7-yl)ethanone

Structure

 1-(9-bromo-6-hydroxy-2,3,4,5-tetrahydro-1H-benzo[d]azepin-7-yl)ethanone
Name: 1-(9-bromo-6-hydroxy-2,3,4,5-tetrahydro-1H-benzo[d]azepin-7-yl)ethanone
Synonyms:
General Information
Product Number: 864262771

CAS Registry Number 864262-77-1
Name:
Ethanone, 1-?(7-?acetyl-?9-?bromo-?1,?2,?4,?5-?tetrahydro-?6-?hydroxy-?3H-?3-?benzazepin-?3-?yl)?-?2,?2,?2-?trifluoro-
1H-3-Benzazepin-6-ol, 7-acetyl-9-bromo-2,3,4,5-tetrahydro-3-(trifluoroacetyl)- (9CI)
7-Acetyl-9-bromo-6-hydroxy-3-(2,2,2-trifluoroacetyl)-2,3,4,5-tetrahydro-1H-benzo[d]azepine

 

Chemical Formula: C12H14BrNO2
Exact Mass: 283.02
Molecular Weight: 284.15
m/z: 283.02 (100.0%), 285.02 (97.3%), 284.02 (13.3%), 286.02 (13.1%), 285.03 (1.2%)

 

InChI:InChI=1S/C14H13BrF3NO3/c1-7(20)10-6-11(15)8-2-4-19(13(22)14(16,17)18)5-3-9(8)12(10)21/h6,21H,2-5H2,1H3

InChI Key:ZNELYYYRFDQGIQ-UHFFFAOYSA-N

Canonical SMILES:CC(=O)C1=CC(=C2CCN(CCC2=C1O)C(=O)C(F)(F)F)Br

Specification

98%
References

PCT Int. Appl. (2007), WO 2007028132 A2 20070308. 

PCT Int. Appl. (2005), WO 2005082859 A1 20050909.
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