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3-Nitro-1-phenyl-1-butanone
SpectraBase Compound ID mUQe4jXEQY
InChI InChI=1S/C10H11NO3/c1-8(11(13)14)7-10(12)9-5-3-2-4-6-9/h2-6,8H,7H2,1H3
InChIKey ZEMBUDLWKVRNIW-UHFFFAOYSA-N
Mol Weight 193.2 g/mol
Molecular Formula C10H11NO3
Exact Mass 193.073893 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7zip1j2qkV5
Name 3-Nitro-1-phenyl-1-butanone
CAS Registry Number 7404-78-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H11NO3
InChI InChI=1S/C10H11NO3/c1-8(11(13)14)7-10(12)9-5-3-2-4-6-9/h2-6,8H,7H2,1H3
InChIKey ZEMBUDLWKVRNIW-UHFFFAOYSA-N
Molecular Weight 193.202 g/mol
SMILES C(N(=O)=O)(C)CC(=O)c1ccccc1
SPLASH splash10-0a4i-6900000000-23a99ab0a8b4c3f5f6da
Synonyms 3-Nitro-1-phenyl-butan-1-one
Wiley ID 1478779