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1-(1-Chloroisoquinolin-7-yl)but-3-en-1-ol
SpectraBase Compound ID FP41j0MSh6P
InChI InChI=1S/C13H12ClNO/c1-2-3-12(16)10-5-4-9-6-7-15-13(14)11(9)8-10/h2,4-8,12,16H,1,3H2
InChIKey RBRPPNPXYWSGSH-UHFFFAOYSA-N
Mol Weight 233.7 g/mol
Molecular Formula C13H12ClNO
Exact Mass 233.060742 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9hgV4I0qO0H
Name 1-(1-Chloroisoquinolin-7-yl)but-3-en-1-ol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H12ClNO
InChI InChI=1S/C13H12ClNO/c1-2-3-12(16)10-5-4-9-6-7-15-13(14)11(9)8-10/h2,4-8,12,16H,1,3H2
InChIKey RBRPPNPXYWSGSH-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol502016h
Molecular Weight 233.698 g/mol
SMILES OC(c1ccc2c(c(ncc2)Cl)c1)CC=C
SPLASH splash10-002f-1900000000-93cfbf042740ba313a21
Source of Spectrum A1-16-4972/SMS11-14a
Wiley ID 1751183