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4-ACETYL-2-BENZOYLAMINO-5,5-PENTAMETHYLEN-4,5-DIHYDRO-1,3,4-THIADIAZOLE
SpectraBase Compound ID DK357Vu1XPu
InChI InChI=1S/C16H19N3O2S/c1-12(20)19-16(10-6-3-7-11-16)22-15(18-19)17-14(21)13-8-4-2-5-9-13/h2,4-5,8-9H,3,6-7,10-11H2,1H3,(H,17,18,21)
InChIKey QZOSWGISDYXRNQ-UHFFFAOYSA-N
Mol Weight 317.41 g/mol
Molecular Formula C16H19N3O2S
Exact Mass 317.119798 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HPULegOzsIu
Name 4-Acetyl-2-benzoylamino-5,5-pentamethylen-4,5-dihydro-1,3,4-thiadiazol
Alternate Name(s) N-(1-acetyl-4-thia-1,2-diazaspiro[4.5]dec-2-en-3-yl)benzamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H19N3O2S
InChI InChI=1S/C16H19N3O2S/c1-12(20)19-16(10-6-3-7-11-16)22-15(18-19)17-14(21)13-8-4-2-5-9-13/h2,4-5,8-9H,3,6-7,10-11H2,1H3,(H,17,18,21)
InChIKey QZOSWGISDYXRNQ-UHFFFAOYSA-N
Literature Reference DOI 10.1002/prac.19863280209
Molecular Weight 317.407 g/mol
SMILES N(C(c1ccccc1)=O)C=1SC2(N(N1)C(=O)C)CCCCC2
SPLASH splash10-0a6r-8900000000-81b1a404763cde6389fb
Source of Spectrum JF-328-211-2l
Wiley ID 1791462