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2H-Isoindole-2-acetonitrile, 1,3-dihydro-1-oxo-
SpectraBase Compound ID GEMMG6m5Zl
InChI InChI=1S/C10H8N2O/c11-5-6-12-7-8-3-1-2-4-9(8)10(12)13/h1-4H,6-7H2
InChIKey MNZLNDUJAIDAHF-UHFFFAOYSA-N
Mol Weight 172.19 g/mol
Molecular Formula C10H8N2O
Exact Mass 172.063663 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AsEGImGgImQ
Name 2H-Isoindole-2-acetonitrile, 1,3-dihydro-1-oxo-
Alternate Name(s) (1-oxo-1,3-dihydro-2H-isoindol-2-yl)acetonitrile 2-(cyanomethyl)isoindolin-1-one 2-(3-oxo-1H-isoindol-2-yl)acetonitrile 2-(1-oxoisoindolin-2-yl)acetonitrile 2-(3-oxidanylidene-1H-isoindol-2-yl)ethanenitrile
CAS Registry Number 129820-48-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H8N2O
InChI InChI=1S/C10H8N2O/c11-5-6-12-7-8-3-1-2-4-9(8)10(12)13/h1-4H,6-7H2
InChIKey MNZLNDUJAIDAHF-UHFFFAOYSA-N
Molecular Weight 172.187 g/mol
SMILES C1(N(Cc2c1cccc2)CC#N)=O
SPLASH splash10-00di-1900000000-b3cf67e4ebcd1fb1425c
Source of Spectrum I-68-850-1
Wiley ID 1168911