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3-ISOPROPYL-5-HYDROXY-1,2,3-OXADIAZOLE;WITH_RESPECT_TO_CH3NO2
SpectraBase Compound ID 5rZCT0vp3vW
InChI InChI=1S/C5H8N2O2/c1-4(2)7-3-5(8)9-6-7/h3-4H,1-2H3
InChIKey MOPOHBGHMCTYJK-UHFFFAOYSA-N
Mol Weight 128.13 g/mol
Molecular Formula C5H8N2O2
Exact Mass 128.058578 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4OZQkEYBCy7
Name Sydnone, 3-isopropyl-
CAS Registry Number 6939-17-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C5H8N2O2
InChI InChI=1S/C5H8N2O2/c1-4(2)7-3-5(8)9-6-7/h3-4H,1-2H3
InChIKey MOPOHBGHMCTYJK-UHFFFAOYSA-N
Molecular Weight 128.131 g/mol
SMILES c1(on[n+](c1)C(C)C)[O-]
SPLASH splash10-0006-9200000000-b35b552e9bb60c256a9f
Source of Spectrum O-2-9546-0
Synonyms 3-isopropyl-2H-oxadiazol-3-ium-5-one 3-Propan-2-yl-2H-1,2,3-oxadiazol-3-ium-5-one 3-Propan-2-yl-2H-oxadiazol-3-ium-5-one AI3-61269 BRN 4135220
Wiley ID 1130944