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

*Links on SpectraBase are not permalinks.
Phenylmethyl .alpha.-[5-(5-nitro-2-furyl)-1,3,4-thiadiazole-2-ylthio]acetate
SpectraBase Compound ID 7B7RLI8Vdci
InChI InChI=1S/C15H11N3O5S2/c19-13(22-8-10-4-2-1-3-5-10)9-24-15-17-16-14(25-15)11-6-7-12(23-11)18(20)21/h1-7H,8-9H2
InChIKey FERMMULRYIWBTB-UHFFFAOYSA-N
Mol Weight 377.39 g/mol
Molecular Formula C15H11N3O5S2
Exact Mass 377.014013 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 DwO0uBTx7Z
Name Phenylmethyl .alpha.-[5-(5-nitro-2-furyl)-1,3,4-thiadiazole-2-ylthio]acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H11N3O5S2
InChI InChI=1S/C15H11N3O5S2/c19-13(22-8-10-4-2-1-3-5-10)9-24-15-17-16-14(25-15)11-6-7-12(23-11)18(20)21/h1-7H,8-9H2
InChIKey FERMMULRYIWBTB-UHFFFAOYSA-N
Literature Reference DOI 10.1002/ardp.200400926
Molecular Weight 377.389 g/mol
SMILES C(CSc1sc(nn1)-c1oc(cc1)[N+](=O)[O-])(=O)OCc1ccccc1
SPLASH splash10-0006-0592000000-378d9aaeac857380218b
Source of Spectrum APC-338-115-6e
Synonyms Benzyl 2-((5-(5-nitrofuran-2-yl)-1,3,4-thiadiazol-2-yl)thio)acetate 2-[[5-(5-nitro-2-furanyl)-1,3,4-thiadiazol-2-yl]thio]acetic acid (phenylmethyl) ester Benzyl 2-[[5-(5-nitrofuran-2-yl)-1,3,4-thiadiazol-2-yl]sulfanyl]acetate Benzyl 2-[[5-(5-nitro-2-furyl)-1,3,4-thiadiazol-2-yl]sulfanyl]acetate (phenylmethyl) 2-[[5-(5-nitrofuran-2-yl)-1,3,4-thiadiazol-2-yl]sulfanyl]ethanoate
Wiley ID 1770888