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1-[(2,2-dimethyl[1,3]dioxolan-4-yl)methyl]-4-nitro-1H-pyrazole
SpectraBase Compound ID 9XOBB31dK8x
InChI InChI=1S/C9H13N3O4/c1-9(2)15-6-8(16-9)5-11-4-7(3-10-11)12(13)14/h3-4,8H,5-6H2,1-2H3
InChIKey DYPKISVCDQCZGA-UHFFFAOYSA-N
Mol Weight 227.22 g/mol
Molecular Formula C9H13N3O4
Exact Mass 227.090606 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Eiwzc3Sr8Dg
Name 1-[(2,2-dimethyl[1,3]dioxolan-4-yl)methyl]-4-nitro-1H-pyrazole
Alternate Name(s) 1-((2,2-dimethyl-1,3-dioxolan-4-yl)methyl)-4-nitro-1H-pyrazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H13N3O4
InChI InChI=1S/C9H13N3O4/c1-9(2)15-6-8(16-9)5-11-4-7(3-10-11)12(13)14/h3-4,8H,5-6H2,1-2H3
InChIKey DYPKISVCDQCZGA-UHFFFAOYSA-N
Molecular Weight 227.220 g/mol
SMILES CC1(C)OCC(O1)C[n]1ncc(c1)[N+](=O)[O-]
SPLASH splash10-03di-0290000000-4e3041e173f6614acca2
Source of Spectrum H-87-476-7
Wiley ID 1785420