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N-(ortho-cyclopropylphenyl)-N'-phenylthiourea
SpectraBase Compound ID 646RqdvhLm2
InChI InChI=1S/C16H16N2S/c19-16(17-13-6-2-1-3-7-13)18-15-9-5-4-8-14(15)12-10-11-12/h1-9,12H,10-11H2,(H2,17,18,19)
InChIKey FGIIVPYAGODARV-UHFFFAOYSA-N
Mol Weight 268.38 g/mol
Molecular Formula C16H16N2S
Exact Mass 268.10342 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B1299zQPgUS
Name N-(ortho-cyclopropylphenyl)-N'-phenylthiourea
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H16N2S
InChI InChI=1S/C16H16N2S/c19-16(17-13-6-2-1-3-7-13)18-15-9-5-4-8-14(15)12-10-11-12/h1-9,12H,10-11H2,(H2,17,18,19)
InChIKey FGIIVPYAGODARV-UHFFFAOYSA-N
Instrument Name Finnigan SSQ 7000
Ionization Type EI
Literature Reference DOI 10.1016/j.jasms.2005.07.006
Molecular Weight 268.378 g/mol
SMILES N(c1c(cccc1)C1CC1)C(Nc1ccccc1)=S
SPLASH splash10-00kf-6960000000-3a5f17c8e3cc955a2961
Source of Spectrum A7-16-1741-15
Wiley ID 1857458