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N-Methoxy-3-(3-chloropropyl)isoquinolin-1(2H)-one
SpectraBase Compound ID 2hRnX4U9jKR
InChI InChI=1S/C13H14ClNO2/c1-17-15-11(6-4-8-14)9-10-5-2-3-7-12(10)13(15)16/h2-3,5,7,9H,4,6,8H2,1H3
InChIKey VZJPQEURVNDOSE-UHFFFAOYSA-N
Mol Weight 251.71 g/mol
Molecular Formula C13H14ClNO2
Exact Mass 251.071306 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9tD6A3XkP0T
Name N-Methoxy-3-(3-chloropropyl)isoquinolin-1(2H)-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H14ClNO2
InChI InChI=1S/C13H14ClNO2/c1-17-15-11(6-4-8-14)9-10-5-2-3-7-12(10)13(15)16/h2-3,5,7,9H,4,6,8H2,1H3
InChIKey VZJPQEURVNDOSE-UHFFFAOYSA-N
Molecular Weight 251.713 g/mol
SMILES C1(N(C(CCCCl)=Cc2c1cccc2)OC)=O
SPLASH splash10-0zfr-0590000000-305c01031cc2d1770d06
Source of Spectrum J-58-3647-9
Synonyms 3-(3-Chloropropyl)-2-methoxy-1(2H)-isoquinolinone
Wiley ID 1254437