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methyl 3-(4-nitro-1H-pyrazol-1-yl)propanoate
SpectraBase Compound ID 8Drz4TziQI5
InChI InChI=1S/C7H9N3O4/c1-14-7(11)2-3-9-5-6(4-8-9)10(12)13/h4-5H,2-3H2,1H3
InChIKey VLENHGGZYGPCJH-UHFFFAOYSA-N
Mol Weight 199.17 g/mol
Molecular Formula C7H9N3O4
Exact Mass 199.059306 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J1orIswLVMr
Name Methyl 3-(4-nitro-1H-pyrazol-1-yl)propanoate
Appearance Yellow oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H9N3O4
InChI InChI=1S/C7H9N3O4/c1-14-7(11)2-3-9-5-6(4-8-9)10(12)13/h4-5H,2-3H2,1H3
InChIKey VLENHGGZYGPCJH-UHFFFAOYSA-N
Instrument Name Agilent Technologies 7890A/5975C
Ionization Type EI
Literature Reference DOI 10.3762/bjoc.7.24
Molecular Weight 199.166 g/mol
SMILES COC(CC[n]1ncc(c1)[N+](=O)[O-])=O
SPLASH splash10-003l-4900000000-9655eff1ab7dcd2529e0
Source of Spectrum BJO-7-SM2-3a
Wiley ID 1867210