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Methyl 3-phenyl-2,4-dinitrobutanoate
SpectraBase Compound ID 34jWO5UHWm8
InChI InChI=1S/C11H12N2O6/c1-19-11(14)10(13(17)18)9(7-12(15)16)8-5-3-2-4-6-8/h2-6,9-10H,7H2,1H3
InChIKey OWRIQCTWBBZUEO-UHFFFAOYSA-N
Mol Weight 268.22 g/mol
Molecular Formula C11H12N2O6
Exact Mass 268.069536 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9CKkGqrKMXD
Name Methyl 3-phenyl-2,4-dinitrobutanoate
Alternate Name(s) Methyl 2,4-dinitro-3-phenylbutanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H12N2O6
InChI InChI=1S/C11H12N2O6/c1-19-11(14)10(13(17)18)9(7-12(15)16)8-5-3-2-4-6-8/h2-6,9-10H,7H2,1H3
InChIKey OWRIQCTWBBZUEO-UHFFFAOYSA-N
Molecular Weight 268.225 g/mol
SMILES C(N(=O)=O)(C(CN(=O)=O)c1ccccc1)C(=O)OC
SPLASH splash10-004i-0910000000-eabfe14e9b4f91ceb393
Source of Spectrum SO-0-65-7
Wiley ID 873087