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9-Anthracenecarbonitrile, 10-[(ethylthio)methyl]-
SpectraBase Compound ID KTxboiGxA9U
InChI InChI=1S/C18H15NS/c1-2-20-12-18-15-9-5-3-7-13(15)17(11-19)14-8-4-6-10-16(14)18/h3-10H,2,12H2,1H3
InChIKey FGMFBMLJFPUSSM-UHFFFAOYSA-N
Mol Weight 277.38 g/mol
Molecular Formula C18H15NS
Exact Mass 277.092521 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Hj4wxPdjHTt
Name 9-Anthracenecarbonitrile, 10-[(ethylthio)methyl]-
Alternate Name(s) 10-[(ethylsulfanyl)methyl]-9-anthracenecarbonitrile 9-Cyano-10-(ethylthiomethyl)anthracene
CAS Registry Number 116865-30-6
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H15NS
InChI InChI=1S/C18H15NS/c1-2-20-12-18-15-9-5-3-7-13(15)17(11-19)14-8-4-6-10-16(14)18/h3-10H,2,12H2,1H3
InChIKey FGMFBMLJFPUSSM-UHFFFAOYSA-N
Molecular Weight 277.385 g/mol
SMILES c1(c2c(cccc2)c(c2c1cccc2)CSCC)C#N
SPLASH splash10-016r-0090000000-78e925f6ede3a1716a14
Source of Spectrum J-53-5442-13
Wiley ID 1281203