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CAS Number: 82771-27-5
1-(1,2,3,4-tetrahydroisoquinolin-7-yl)ethanone hydrochloride

Structure

 1-(1,2,3,4-tetrahydroisoquinolin-7-yl)ethanone hydrochloride
Name: 1-(1,2,3,4-tetrahydroisoquinolin-7-yl)ethanone hydrochloride
Synonyms:
General Information
Product Number: 82771275

CAS Registry Number 82771-27-5
(Component: 82771-59-3)
Name:
Ethanone, 1-?(1,?2,?3,?4-?tetrahydro-?7-?isoquinolinyl)?-?, hydrochloride (1:1)
Ethanone, 1-(1,2,3,4-tetrahydro-7-isoquinolinyl)-, hydrochloride (9CI)

 

Chemical Formula: C11H14ClNO
Exact Mass: 211.08
Molecular Weight: 211.69
m/z: 211.08 (100.0%), 213.07 (32.0%), 212.08 (12.1%), 214.08 (3.9%)

 

InChI:InChI=1S/C11H13NO.ClH/c1-8(13)10-3-2-9-4-5-12-7-11(9)6-10;/h2-3,6,12H,4-5,7H2,1H3;1H

InChI Key:XXKMOPZYIXRHNB-UHFFFAOYSA-N

Canonical SMILES:CC(=O)C1=CC2=C(CCNC2)C=C1.Cl

 

Thermal Properties Value Condition Note
Melting Point 230-231 °C Solv: ethanol (64-17-5) (1)IC

Specification

98%
References
  1. (1) Ali, Fadia El-Fehail; Journal of Medicinal Chemistry 1982, V25(10), P1235-40 CAPLUS
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