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3-[[5-(2-naphthalenyl)-4-thiadiazolyl]thio]propanoic acid ethyl ester
SpectraBase Compound ID 5VEh1UlinsD
InChI InChI=1S/C17H16N2O2S2/c1-2-21-15(20)9-10-22-17-16(23-19-18-17)14-8-7-12-5-3-4-6-13(12)11-14/h3-8,11H,2,9-10H2,1H3
InChIKey VFKMWDBJJYGYON-UHFFFAOYSA-N
Mol Weight 344.45 g/mol
Molecular Formula C17H16N2O2S2
Exact Mass 344.06532 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID h4EUdMH18O
Name 3-[[5-(2-naphthalenyl)-4-thiadiazolyl]thio]propanoic acid ethyl ester
CAS Registry Number 114393-34-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H16N2O2S2
InChI InChI=1S/C17H16N2O2S2/c1-2-21-15(20)9-10-22-17-16(23-19-18-17)14-8-7-12-5-3-4-6-13(12)11-14/h3-8,11H,2,9-10H2,1H3
InChIKey VFKMWDBJJYGYON-UHFFFAOYSA-N
Molecular Weight 344.447 g/mol
SMILES c1(c(nns1)SCCC(=O)OCC)-c1cc2ccccc2cc1
SPLASH splash10-00fr-0954000000-41e2936a496fbd76385c
Source of Spectrum Y-25-1881-2
Synonyms 3-[[5-(2-naphthyl)thiadiazol-4-yl]thio]propionic acid ethyl ester Ethyl 3-(5-naphthalen-2-ylthiadiazol-4-yl)sulfanylpropanoate Ethyl 3-[(5-naphthalen-2-yl-1,2,3-thiadiazol-4-yl)sulfanyl]propanoate Ethyl 3-[5-(2-naphthyl)thiadiazol-4-yl]sulfanylpropanoate
Wiley ID 1337738