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5-(p-chlorophenyl)-3-phenyl-1-thiocarboxamide-2-pyrazoline
SpectraBase Compound ID Ke5fvkMKzfu
InChI InChI=1S/C16H14ClN3S/c17-13-8-6-12(7-9-13)15-10-14(19-20(15)16(18)21)11-4-2-1-3-5-11/h1-9,15H,10H2,(H2,18,21)
InChIKey HTPUPBFMBAESEN-UHFFFAOYSA-N
Mol Weight 315.82 g/mol
Molecular Formula C16H14ClN3S
Exact Mass 315.059696 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4DMDkLzXw8s
Name 5-(p-chlorophenyl)-3-phenyl-1-thiocarboxamide-2-pyrazoline
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H14ClN3S
InChI InChI=1S/C16H14ClN3S/c17-13-8-6-12(7-9-13)15-10-14(19-20(15)16(18)21)11-4-2-1-3-5-11/h1-9,15H,10H2,(H2,18,21)
InChIKey HTPUPBFMBAESEN-UHFFFAOYSA-N
Instrument Name Jeol JMS-D100 or Finnigan MAT TSQ700
Ionization Type EI
Literature Reference DOI 10.1002_(SICI)1097-0231(19980715)12_13_833
Molecular Weight 315.822 g/mol
SMILES NC(N1N=C(c2ccccc2)CC1c1ccc(cc1)Cl)=S
SPLASH splash10-0ars-5493000000-e8747c285274c74ebaac
Source of Spectrum RCM-12-834-3
Wiley ID 1837677