For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
2-acetamino-4-acetyl-5-methyl-deltasquare-1,3,4-thiadiazolium-5-propionic acid, methyl ester
SpectraBase Compound ID LHhmslqPslO
InChI InChI=1S/C11H17N3O4S/c1-7(15)12-10-13-14(8(2)16)11(3,19-10)6-5-9(17)18-4/h5-6H2,1-4H3,(H,12,13,15)
InChIKey ZIKCPSVLVFCBLP-UHFFFAOYSA-N
Mol Weight 287.33 g/mol
Molecular Formula C11H17N3O4S
Exact Mass 287.093977 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID HAwso1s1XKB
Name 4-Acetyl-2-acetylamino-5-(2-methoxycarbonyl)ethyl-5-methyl-4,5-dihydro-1,3,4-thiadiazol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H17N3O4S
InChI InChI=1S/C11H17N3O4S/c1-7(15)12-10-13-14(8(2)16)11(3,19-10)6-5-9(17)18-4/h5-6H2,1-4H3,(H,12,13,15)
InChIKey ZIKCPSVLVFCBLP-UHFFFAOYSA-N
Literature Reference DOI 10.1002/prac.19863280209
Molecular Weight 287.334 g/mol
SMILES N(C(=O)C)C=1SC(N(N1)C(=O)C)(C)CCC(=O)OC
SPLASH splash10-052f-9800000000-9470fd88941ec7166189
Source of Spectrum JF-328-211-2e
Synonyms Methyl 3-(5-acetamido-3-acetyl-2-methyl-2,3-dihydro-1,3,4-thiadiazol-2-yl)propanoate
Wiley ID 1791456