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5-(Deuteriomethyl)-3-methyl-4-nitroisoxazole
SpectraBase Compound ID Cuhnke8t3dm
InChI InChI=1S/C5H6N2O3/c1-3-5(7(8)9)4(2)10-6-3/h1-2H3/i2D3
InChIKey PMQFLWLYAXYFHG-BMSJAHLVSA-N
Mol Weight 145.13 g/mol
Molecular Formula C5H3D3N2O3
Exact Mass 145.056672 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3uqdzo78t0I
Name 5-(Deuteriomethyl)-3-methyl-4-nitroisoxazole
CAS Registry Number 108418-34-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C5H3D3N2O3
InChI InChI=1S/C5H6N2O3/c1-3-5(7(8)9)4(2)10-6-3/h1-2H3/i2D3
InChIKey PMQFLWLYAXYFHG-BMSJAHLVSA-N
Molecular Weight 145.132 g/mol
SMILES c1(onc(c1N(=O)=O)C)C([D])([D])[D]
SPLASH splash10-0007-9300000000-2c6f29fbb19528c76497
Source of Spectrum J-52-3639-4
Wiley ID 1140586