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2-(p-Methylbenzylsulfanyl)phenylisothiocyanate
SpectraBase Compound ID 93fLsIe7Mpn
InChI InChI=1S/C15H13NS2/c1-12-6-8-13(9-7-12)10-18-15-5-3-2-4-14(15)16-11-17/h2-9H,10H2,1H3
InChIKey OGZKPHMRNCUQFV-UHFFFAOYSA-N
Mol Weight 271.4 g/mol
Molecular Formula C15H13NS2
Exact Mass 271.048942 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KPtqWxcFdlK
Name 2-(p-Methylbenzylsulfanyl)phenylisothiocyanate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H13NS2
InChI InChI=1S/C15H13NS2/c1-12-6-8-13(9-7-12)10-18-15-5-3-2-4-14(15)16-11-17/h2-9H,10H2,1H3
InChIKey OGZKPHMRNCUQFV-UHFFFAOYSA-N
Molecular Weight 271.396 g/mol
SMILES c1(N=C=S)c(SCc2ccc(cc2)C)cccc1
SPLASH splash10-0ai0-0790000000-e996fd194d4b96340443
Source of Spectrum H1-41-2266-8
Synonyms 1-isothiocyanato-2-[(4-methylbenzyl)sulfanyl]benzene
Wiley ID 757439