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3-METHYL-4-NITRO-5-STYRYLISOXAZOLE
SpectraBase Compound ID AnN74vkfBsW
InChI InChI=1S/C12H10N2O3/c1-9-12(14(15)16)11(17-13-9)8-7-10-5-3-2-4-6-10/h2-8H,1H3/b8-7+
InChIKey SDCPXLWJUGXAEK-BQYQJAHWSA-N
Mol Weight 230.22 g/mol
Molecular Formula C12H10N2O3
Exact Mass 230.069142 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9WAr1KJ3lBd
Name Isoxazole, 3-methyl-4-nitro-5-(2-phenylethenyl)-
CAS Registry Number 53557-94-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H10N2O3
InChI InChI=1S/C12H10N2O3/c1-9-12(14(15)16)11(17-13-9)8-7-10-5-3-2-4-6-10/h2-8H,1H3/b8-7+
InChIKey SDCPXLWJUGXAEK-BQYQJAHWSA-N
Molecular Weight 230.223 g/mol
SMILES c1(N(=O)=O)c(onc1C)\C=C\c1ccccc1
SPLASH splash10-001i-1590000000-6a341ccb3600ac9c9901
Source of Spectrum O-15-659-1
Synonyms 3-Methyl-4-nitro-5-styrylisoxazole 3-Methyl-4-nitro-5-[(E)-2-phenylethenyl]-1,2-oxazole 3-Methyl-4-nitro-5-[(E)-2-phenylethenyl]isoxazole 3-Methyl-4-nitro-5-[(E)-styryl]isoxazole
Wiley ID 1231541