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4-(5-mercapto-1,3,4-oxadiazol-2-yl)-phthalazin-1(2H)-one
SpectraBase Compound ID JOIallnoPeo
InChI InChI=1S/C10H6N4O2S/c15-8-6-4-2-1-3-5(6)7(11-12-8)9-13-14-10(17)16-9/h1-4H,(H,12,15)(H,14,17)
InChIKey COFIOXURSVQHCC-UHFFFAOYSA-N
Mol Weight 246.24 g/mol
Molecular Formula C10H6N4O2S
Exact Mass 246.021147 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GTjP5Pxey
Name 4-(5-mercapto-1,3,4-oxadiazol-2-yl)-phthalazin-1(2H)-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H6N4O2S
InChI InChI=1S/C10H6N4O2S/c15-8-6-4-2-1-3-5(6)7(11-12-8)9-13-14-10(17)16-9/h1-4H,(H,12,15)(H,14,17)
InChIKey COFIOXURSVQHCC-UHFFFAOYSA-N
Literature Reference DOI 10.1002/cjoc.201180264
Molecular Weight 246.244 g/mol
SMILES N1N=C(c2nnc(o2)S)c2ccccc2C1=O
SPLASH splash10-0ufs-4930000000-0864c9c9c7916fadbd30
Source of Spectrum CJC-29-1449-5
Synonyms 4-(5-mercapto-1,3,4-oxadiazol-2-yl)phthalazin-1(2H)-one
Wiley ID 1772589