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3-Nitro-1-phenyl-1-propanone
SpectraBase Compound ID 3LZiGx5rtHW
InChI InChI=1S/C9H9NO3/c11-9(6-7-10(12)13)8-4-2-1-3-5-8/h1-5H,6-7H2
InChIKey PMBFWZPQKKUBSU-UHFFFAOYSA-N
Mol Weight 179.17 g/mol
Molecular Formula C9H9NO3
Exact Mass 179.058243 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AgeBzkdRIpb
Name 3-Nitro-1-phenyl-1-propanone
CAS Registry Number 62847-52-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H9NO3
InChI InChI=1S/C9H9NO3/c11-9(6-7-10(12)13)8-4-2-1-3-5-8/h1-5H,6-7H2
InChIKey PMBFWZPQKKUBSU-UHFFFAOYSA-N
Molecular Weight 179.175 g/mol
SMILES c1ccc(C(CCN(=O)=O)=O)cc1
SPLASH splash10-0pdi-9400000000-c6579c0a41faac157fd6
Source of Spectrum AD-0-2532-0
Synonyms 3-Nitro-1-phenyl-propan-1-one Propan-1-one, 3-nitro-1-phenyl-
Wiley ID 1420531