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1-(3-nitrophenyl)-3-oxidanyl-propan-2-one
SpectraBase Compound ID 60xiHqvitcR
InChI InChI=1S/C9H9NO4/c11-6-9(12)5-7-2-1-3-8(4-7)10(13)14/h1-4,11H,5-6H2
InChIKey XXSYXYQIZFSOPI-UHFFFAOYSA-N
Mol Weight 195.17 g/mol
Molecular Formula C9H9NO4
Exact Mass 195.053158 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Is6TOlMYfTe
Name 1-(3-nitrophenyl)-3-oxidanyl-propan-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H9NO4
InChI InChI=1S/C9H9NO4/c11-6-9(12)5-7-2-1-3-8(4-7)10(13)14/h1-4,11H,5-6H2
InChIKey XXSYXYQIZFSOPI-UHFFFAOYSA-N
Molecular Weight 195.174 g/mol
SMILES OCC(=O)Cc1cc(N(=O)=O)ccc1
SPLASH splash10-000j-0900000000-17b19de582ed75e1afc5
Source of Spectrum F-55-6507-3
Synonyms 1-Hydroxy-3-(3-nitrophenyl)-2-propanone 1-Hydroxy-3-(3-nitrophenyl)acetone 1-Hydroxy-3-(3-nitrophenyl)propan-2-one
Wiley ID 838076