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5-Cyano-1-benzylisatin
SpectraBase Compound ID GRUlEQovgnu
InChI InChI=1S/C16H10N2O2/c17-9-12-6-7-14-13(8-12)15(19)16(20)18(14)10-11-4-2-1-3-5-11/h1-8H,10H2
InChIKey MQJCIOVYNUUULX-UHFFFAOYSA-N
Mol Weight 262.27 g/mol
Molecular Formula C16H10N2O2
Exact Mass 262.074228 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BsuuElOiM3j
Name 5-Cyano-1-benzylisatin
Appearance Orange needles
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 262.074227568 u
Formula C16H10N2O2
InChI InChI=1S/C16H10N2O2/c17-9-12-6-7-14-13(8-12)15(19)16(20)18(14)10-11-4-2-1-3-5-11/h1-8H,10H2
InChIKey MQJCIOVYNUUULX-UHFFFAOYSA-N
Instrument Name Hitachi 80-B
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.0002.105
Quality 112
Reported Formula C16H10N2O2
SMILES C1(=CC2=C(C=C1)N(C(C2=O)=O)CC1=CC=CC=C1)C#N
SPLASH splash10-006x-9550000000-6a37706fd5fe4eaa200b
Source of Spectrum ARK-2001-72-3g (DOI: 10.3998/ark.5550190.0002.105)
Wiley ID 1908634