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2-(4-Methylphenylamino)-5-heptyl-1,3,4-thiadiazole
SpectraBase Compound ID 4PK9XDvmIsX
InChI InChI=1S/C16H23N3S/c1-3-4-5-6-7-8-15-18-19-16(20-15)17-14-11-9-13(2)10-12-14/h9-12H,3-8H2,1-2H3,(H,17,19)
InChIKey HEKDLBKYLVAZNP-UHFFFAOYSA-N
Mol Weight 289.44 g/mol
Molecular Formula C16H23N3S
Exact Mass 289.161269 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Whcbj4rjCs
Name 2-(4-Methylphenylamino)-5-heptyl-1,3,4-thiadiazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H23N3S
InChI InChI=1S/C16H23N3S/c1-3-4-5-6-7-8-15-18-19-16(20-15)17-14-11-9-13(2)10-12-14/h9-12H,3-8H2,1-2H3,(H,17,19)
InChIKey HEKDLBKYLVAZNP-UHFFFAOYSA-N
Molecular Weight 289.441 g/mol
SMILES N(c1sc(nn1)CCCCCCC)c1ccc(cc1)C
SPLASH splash10-05n0-0090000000-09e164173688516c224b
Source of Spectrum Y1-33-586-7
Synonyms 5-Heptyl-N-(4-methylphenyl)-1,3,4-thiadiazol-2-amine N-(5-heptyl-1,3,4-thiadiazol-2-yl)-N-(4-methylphenyl)amine
Wiley ID 1526270