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Benzyl 5-amino-4-(2-hydroxybenzoyl)-1H-pyrazole-1-carbodithioate
SpectraBase Compound ID 6Cn9xhqO4cc
InChI InChI=1S/C18H15N3O2S2/c19-17-14(16(23)13-8-4-5-9-15(13)22)10-20-21(17)18(24)25-11-12-6-2-1-3-7-12/h1-10,22H,11,19H2
InChIKey KJSZIFCUWQYGOT-UHFFFAOYSA-N
Mol Weight 369.46 g/mol
Molecular Formula C18H15N3O2S2
Exact Mass 369.060569 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 37ciojQk9Pa
Name Benzyl 5-amino-4-(2-hydroxybenzoyl)-1H-pyrazole-1-carbodithioate
Appearance Pale yellow crystals
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H15N3O2S2
InChI InChI=1S/C18H15N3O2S2/c19-17-14(16(23)13-8-4-5-9-15(13)22)10-20-21(17)18(24)25-11-12-6-2-1-3-7-12/h1-10,22H,11,19H2
InChIKey KJSZIFCUWQYGOT-UHFFFAOYSA-N
Instrument Name Shimadzu GC-2010
Ionization Type EI
Literature Reference DOI 10.1002/jhet.3495
Molecular Weight 369.457 g/mol
SMILES Nc1c(C(c2ccccc2O)=O)cn[n]1C(=S)SCc1ccccc1
SPLASH splash10-02fx-9502000000-cb8da1def7e450b5dfd3
Source of Spectrum Y-56-1081-6
Wiley ID 1859483