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5-Chloro-1-(1-methylethyl)-3-[1-(phenylsulfanyl)ethyl]-1H-pyrazole
SpectraBase Compound ID 5lDLXZu6X1o
InChI InChI=1S/C14H17ClN2S/c1-10(2)17-14(15)9-13(16-17)11(3)18-12-7-5-4-6-8-12/h4-11H,1-3H3
InChIKey ICBPJMRWECCTHJ-UHFFFAOYSA-N
Mol Weight 280.82 g/mol
Molecular Formula C14H17ClN2S
Exact Mass 280.080097 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DsGQ5TdTQ5T
Name 5-Chloro-1-(1-methylethyl)-3-[1-(phenylsulfanyl)ethyl]-1H-pyrazole
Appearance Yellow oil
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H17ClN2S
InChI InChI=1S/C14H17ClN2S/c1-10(2)17-14(15)9-13(16-17)11(3)18-12-7-5-4-6-8-12/h4-11H,1-3H3
InChIKey ICBPJMRWECCTHJ-UHFFFAOYSA-N
Instrument Name Shimadzu GCMS-QP5050A
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.p009.383
Molecular Weight 280.817 g/mol
SMILES c1(Cl)cc(n[n]1C(C)C)C(C)Sc1ccccc1
SPLASH splash10-00b9-0900000000-7ca243c07db777fefde0
Source of Spectrum ARK-2016-95-7
Wiley ID 1843436