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2-methyl-6-naphtho[1,2-b][1]benzothiolecarbonitrile

View entire compound with spectra: 1 MS (GC)

2-methyl-6-naphtho[1,2-b][1]benzothiolecarbonitrile
SpectraBase Compound ID kGZSwQv6dQ
InChI InChI=1S/C18H11NS/c1-11-6-7-12-9-13(10-19)17-14-4-2-3-5-16(14)20-18(17)15(12)8-11/h2-9H,1H3
InChIKey QQUBJDJUSWCRLG-UHFFFAOYSA-N
Mol Weight 273.35 g/mol
Molecular Formula C18H11NS
Exact Mass 273.061221 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BCbAuwBqkJw
Name 2-methyl-6-naphtho[1,2-b][1]benzothiolecarbonitrile
Alternate Name(s) 2-methylnaphtho[1,2-b]benzothiophene-6-carbonitrile 2-methylnaphtho[1,2-b][1]benzothiole-6-carbonitrile 2-methylnaphtho[1,2-b][1]benzothiophene-6-carbonitrile
CAS Registry Number 89817-42-5
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H11NS
InChI InChI=1S/C18H11NS/c1-11-6-7-12-9-13(10-19)17-14-4-2-3-5-16(14)20-18(17)15(12)8-11/h2-9H,1H3
InChIKey QQUBJDJUSWCRLG-UHFFFAOYSA-N
Molecular Weight 273.353 g/mol
SMILES c12sc3ccccc3c2c(C#N)cc2c1cc(cc2)C
SPLASH splash10-00di-0090000000-b197be7c8bd2a1ab38ab
Source of Spectrum Y-20-1457-0
Wiley ID 1277438