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n-Propyl .alpha.-[5-(5-nitro-2-furyl)-1,3,4-thiadiazole-2-ylthio]acetate
SpectraBase Compound ID LgVf1ClS9Ml
InChI InChI=1S/C11H11N3O5S2/c1-2-5-18-9(15)6-20-11-13-12-10(21-11)7-3-4-8(19-7)14(16)17/h3-4H,2,5-6H2,1H3
InChIKey MPHPTDYEYSLPRN-UHFFFAOYSA-N
Mol Weight 329.35 g/mol
Molecular Formula C11H11N3O5S2
Exact Mass 329.014013 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4mPAsMfE2BO
Name n-Propyl .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 C11H11N3O5S2
InChI InChI=1S/C11H11N3O5S2/c1-2-5-18-9(15)6-20-11-13-12-10(21-11)7-3-4-8(19-7)14(16)17/h3-4H,2,5-6H2,1H3
InChIKey MPHPTDYEYSLPRN-UHFFFAOYSA-N
Molecular Weight 329.345 g/mol
SMILES C(CSc1sc(nn1)-c1oc(cc1)[N+](=O)[O-])(=O)OCCC
SPLASH splash10-0006-0392000000-1dffac9f83db77eb7cee
Source of Spectrum APC-338-115-6c
Synonyms Propyl 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 propyl ester Propyl 2-[[5-(5-nitrofuran-2-yl)-1,3,4-thiadiazol-2-yl]sulfanyl]acetate Propyl 2-[[5-(5-nitro-2-furyl)-1,3,4-thiadiazol-2-yl]sulfanyl]acetate Propyl 2-[[5-(5-nitrofuran-2-yl)-1,3,4-thiadiazol-2-yl]sulfanyl]ethanoate
Wiley ID 1770886