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Isopropyl 3,5-dinitrobenzoate

View entire compound with spectra: 2 MS (GC)

Isopropyl 3,5-dinitrobenzoate
SpectraBase Compound ID ICRn0youQ2u
InChI InChI=1S/C10H10N2O6/c1-6(2)18-10(13)7-3-8(11(14)15)5-9(4-7)12(16)17/h3-6H,1-2H3/i1D
InChIKey FAYNAMQMBONHIQ-MICDWDOJSA-N
Mol Weight 255.2 g/mol
Molecular Formula C10H92DN2O6
Exact Mass 255.060163 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4abSjauhM7N
Name Isopropyl 3,5-dinitrobenzoate
CAS Registry Number 89968-69-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H9DN2O6
InChI InChI=1S/C10H10N2O6/c1-6(2)18-10(13)7-3-8(11(14)15)5-9(4-7)12(16)17/h3-6H,1-2H3/i1D
InChIKey FAYNAMQMBONHIQ-MICDWDOJSA-N
Molecular Weight 255.204 g/mol
SMILES c1(N(=O)=O)cc(cc(c1)N(=O)=O)C(=O)OC(C)C[2D]
SPLASH splash10-0005-9510000000-b5b23eb37f011255c74d
Source of Spectrum H-67-297-0
Wiley ID 1257207