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1,2,4-Oxadiazole, 3-(1,3-benzodioxol-5-yl)-5-[3-(3-nitro-1H-pyrazol-1-yl)propyl]-
SpectraBase Compound ID DKV9SdVaPuB
InChI InChI=1S/C15H13N5O5/c21-20(22)13-5-7-19(17-13)6-1-2-14-16-15(18-25-14)10-3-4-11-12(8-10)24-9-23-11/h3-5,7-8H,1-2,6,9H2
InChIKey NIWXJIXBNYOLLD-UHFFFAOYSA-N
Mol Weight 343.3 g/mol
Molecular Formula C15H13N5O5
Exact Mass 343.091669 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DuDRb1BYUwJ
Name 1,2,4-Oxadiazole, 3-(1,3-benzodioxol-5-yl)-5-[3-(3-nitro-1H-pyrazol-1-yl)propyl]-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H13N5O5
InChI InChI=1S/C15H13N5O5/c21-20(22)13-5-7-19(17-13)6-1-2-14-16-15(18-25-14)10-3-4-11-12(8-10)24-9-23-11/h3-5,7-8H,1-2,6,9H2
InChIKey NIWXJIXBNYOLLD-UHFFFAOYSA-N
Molecular Weight 343.299 g/mol
SMILES c1c2c(ccc1-c1noc(n1)CCC[n]1ccc(n1)N(=O)=O)OCO2
SPLASH splash10-08fr-9601000000-2b86df03ad429aabde06
Source of Spectrum IY-2-4729-9
Synonyms 3-(1,3-benzodioxol-5-yl)-5-[3-(3-nitro-1-pyrazolyl)propyl]-1,2,4-oxadiazole
Wiley ID 1655282