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

*Links on SpectraBase are not permalinks.
1-Oxo-1,2-dihydroisoquinoline-7-carbonitrile
SpectraBase Compound ID JdBOYTb029H
InChI InChI=1S/C10H6N2O/c11-6-7-1-2-8-3-4-12-10(13)9(8)5-7/h1-5H,(H,12,13)
InChIKey HGGJDPGZCATJNC-UHFFFAOYSA-N
Mol Weight 170.17 g/mol
Molecular Formula C10H6N2O
Exact Mass 170.048013 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 KmNWUoMTZYK
Name 1-Oxo-1,2-dihydroisoquinoline-7-carbonitrile
Appearance Pale yellow solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 170.048012820 u
Formula C10H6N2O
InChI InChI=1S/C10H6N2O/c11-6-7-1-2-8-3-4-12-10(13)9(8)5-7/h1-5H,(H,12,13)
InChIKey HGGJDPGZCATJNC-UHFFFAOYSA-N
Instrument Name Finnigan MAT 8200
Ionization Type EI
Literature Reference DOI 10.1002/chem.201500173
Quality 438
Reported Formula C10H6N2O
SMILES N1C=CC2=C(C1=O)C=C(C=C2)C#N
SPLASH splash10-006x-9600000000-5ee1d04d31977817a095
Source of Spectrum QE-21-SM19-S5 (DOI: 10.1002/chem.201500173)
Thin-Layer Chromatography 0.40 (EtOAc)
Wiley ID 1906449