For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
1-allyl-1H-isoquinoline-2-carboxylic acid methyl ester
SpectraBase Compound ID 7gRR7LHpnNo
InChI InChI=1S/C14H15NO2/c1-3-6-13-12-8-5-4-7-11(12)9-10-15(13)14(16)17-2/h3-5,7-10,13H,1,6H2,2H3
InChIKey DXJHONQCRIVANY-UHFFFAOYSA-N
Mol Weight 229.28 g/mol
Molecular Formula C14H15NO2
Exact Mass 229.110279 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 7nN4v8EGLFb
Name 1-allyl-1H-isoquinoline-2-carboxylic acid methyl ester
CAS Registry Number 94161-94-1
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H15NO2
InChI InChI=1S/C14H15NO2/c1-3-6-13-12-8-5-4-7-11(12)9-10-15(13)14(16)17-2/h3-5,7-10,13H,1,6H2,2H3
InChIKey DXJHONQCRIVANY-UHFFFAOYSA-N
Molecular Weight 229.279 g/mol
SMILES C(N1C=Cc2c(C1CC=C)cccc2)(=O)OC
SPLASH splash10-000i-0900000000-a001c841804d115d5e54
Source of Spectrum J-53-3512-16
Synonyms 1-prop-2-enyl-1H-isoquinoline-2-carboxylic acid methyl ester methyl 1-allyl-1H-isoquinoline-2-carboxylate methyl 1-allyl-2(1H)-isoquinolinecarboxylate methyl 1-prop-2-enyl-1H-isoquinoline-2-carboxylate
Wiley ID 1230842