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4-(2,4-dichlorophenyl)-3-(1-naphthalenylmethyl)-1H-1,2,4-triazole-5-thione
SpectraBase Compound ID 2RSZMKfQhhw
InChI InChI=1S/C19H13Cl2N3S/c20-14-8-9-17(16(21)11-14)24-18(22-23-19(24)25)10-13-6-3-5-12-4-1-2-7-15(12)13/h1-9,11H,10H2,(H,23,25)
InChIKey QREXIJLYJNKISI-UHFFFAOYSA-N
Mol Weight 386.3 g/mol
Molecular Formula C19H13Cl2N3S
Exact Mass 385.020724 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4i5qOPptj1E
Name 4-(2,4-dichlorophenyl)-3-(1-naphthalenylmethyl)-1H-1,2,4-triazole-5-thione
Alternate Name(s) 4-(2,4-dichlorophenyl)-3-(1-naphthylmethyl)-1H-1,2,4-triazole-5-thione 4-(2,4-dichlorophenyl)-3-(naphthalen-1-ylmethyl)-1H-1,2,4-triazole-5-thione
CAS Registry Number 77052-85-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H13Cl2N3S
InChI InChI=1S/C19H13Cl2N3S/c20-14-8-9-17(16(21)11-14)24-18(22-23-19(24)25)10-13-6-3-5-12-4-1-2-7-15(12)13/h1-9,11H,10H2,(H,23,25)
InChIKey QREXIJLYJNKISI-UHFFFAOYSA-N
Molecular Weight 386.300 g/mol
SMILES N1N=C(N(C1=S)c1c(cc(cc1)Cl)Cl)Cc1c2c(cccc2)ccc1
SPLASH splash10-014l-1900000000-aa23cff8b4f75f0f1016
Source of Spectrum Y-17-1370-5
Wiley ID 1362139