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2-Isobutyl-5-(2-nitro-phenyl)-[1,3,4]oxadiazole
SpectraBase Compound ID GEdvhtflWzd
InChI InChI=1S/C12H13N3O3/c1-8(2)7-11-13-14-12(18-11)9-5-3-4-6-10(9)15(16)17/h3-6,8H,7H2,1-2H3
InChIKey NQEZNXVIWRMRBR-UHFFFAOYSA-N
Mol Weight 247.25 g/mol
Molecular Formula C12H13N3O3
Exact Mass 247.095691 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5kjLyrVNAyN
Name 2-Isobutyl-5-(2-nitro-phenyl)-[1,3,4]oxadiazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H13N3O3
InChI InChI=1S/C12H13N3O3/c1-8(2)7-11-13-14-12(18-11)9-5-3-4-6-10(9)15(16)17/h3-6,8H,7H2,1-2H3
InChIKey NQEZNXVIWRMRBR-UHFFFAOYSA-N
Molecular Weight 247.254 g/mol
SMILES c1(nnc(o1)CC(C)C)-c1c(N(=O)=O)cccc1
SPLASH splash10-0udi-9300000000-b3939053139b5b1ac3d2
Synonyms 2-(2-Methylpropyl)-5-(2-nitrophenyl)-1,3,4-oxadiazole
Wiley ID 1450258