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Benzeneacetic acid, 4-nitro-, 2-oxopropyl ester
SpectraBase Compound ID IHpWFBW4enI
InChI InChI=1S/C11H11NO5/c1-8(13)7-17-11(14)6-9-2-4-10(5-3-9)12(15)16/h2-5H,6-7H2,1H3
InChIKey GVHIFSIYBZUQMS-UHFFFAOYSA-N
Mol Weight 237.21 g/mol
Molecular Formula C11H11NO5
Exact Mass 237.063722 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4BqD0IAEhuy
Name Benzeneacetic acid, 4-nitro-, 2-oxopropyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H11NO5
InChI InChI=1S/C11H11NO5/c1-8(13)7-17-11(14)6-9-2-4-10(5-3-9)12(15)16/h2-5H,6-7H2,1H3
InChIKey GVHIFSIYBZUQMS-UHFFFAOYSA-N
Molecular Weight 237.211 g/mol
SMILES CC(=O)COC(=O)Cc1ccc(cc1)[N+]([O-])=O
SPLASH splash10-002u-7900000000-dea3f59fca15b6d92421
Source of Spectrum JX-2015-1-111
Synonyms 2-Oxopropyl 2-(4-nitrophenyl)acetate 2-Oxopropyl (4-nitrophenyl)acetate 2-(4-nitrophenyl)acetic acid 2-oxopropyl ester Acetonyl 2-(4-nitrophenyl)acetate 2-Oxidanylidenepropyl 2-(4-nitrophenyl)ethanoate
Wiley ID 1720969