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1,2,4-Oxadiazole, 3-(1,3-benzodioxol-5-yl)-5-(1-methyl-3-nitro-1H-pyrazol-5-yl)-
SpectraBase Compound ID EtnRb4aHfSp
InChI InChI=1S/C13H9N5O5/c1-17-8(5-11(15-17)18(19)20)13-14-12(16-23-13)7-2-3-9-10(4-7)22-6-21-9/h2-5H,6H2,1H3
InChIKey ZQTXMJFVYGNPPC-UHFFFAOYSA-N
Mol Weight 315.25 g/mol
Molecular Formula C13H9N5O5
Exact Mass 315.060368 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AThMsjSo197
Name 1,2,4-Oxadiazole, 3-(1,3-benzodioxol-5-yl)-5-(1-methyl-3-nitro-1H-pyrazol-5-yl)-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H9N5O5
InChI InChI=1S/C13H9N5O5/c1-17-8(5-11(15-17)18(19)20)13-14-12(16-23-13)7-2-3-9-10(4-7)22-6-21-9/h2-5H,6H2,1H3
InChIKey ZQTXMJFVYGNPPC-UHFFFAOYSA-N
Molecular Weight 315.245 g/mol
SMILES c1c2c(ccc1-c1noc(n1)-c1[n](nc(c1)N(=O)=O)C)OCO2
SPLASH splash10-03xr-7904000000-938078a0a3a84cab4aa8
Source of Spectrum IY-2-5158-7
Synonyms 3-(2H-1,3-benzodioxol-5-yl)-5-(1-methyl-3-nitro-1H-pyrazol-5-yl)-1,2,4-oxadiazole 3-(1,3-benzodioxol-5-yl)-5-(2-methyl-5-nitro-3-pyrazolyl)-1,2,4-oxadiazole 3-(1,3-benzodioxol-5-yl)-5-(2-methyl-5-nitropyrazol-3-yl)-1,2,4-oxadiazole
Wiley ID 1659570