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2-Acetamido-4-(benzylamino)-5-nitroacetophenone
SpectraBase Compound ID 2iiN9MiVbTj
InChI InChI=1S/C17H17N3O4/c1-11(21)14-8-17(20(23)24)16(9-15(14)19-12(2)22)18-10-13-6-4-3-5-7-13/h3-9,18H,10H2,1-2H3,(H,19,22)
InChIKey IBQVOHFPTLHDFM-UHFFFAOYSA-N
Mol Weight 327.34 g/mol
Molecular Formula C17H17N3O4
Exact Mass 327.121906 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BPKAwvEnPv
Name 2-Acetamido-4-(benzylamino)-5-nitroacetophenone
Alternate Name(s) N-[2-acetyl-5-(benzylamino)-4-nitrophenyl]acetamide
CAS Registry Number 96228-49-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H17N3O4
InChI InChI=1S/C17H17N3O4/c1-11(21)14-8-17(20(23)24)16(9-15(14)19-12(2)22)18-10-13-6-4-3-5-7-13/h3-9,18H,10H2,1-2H3,(H,19,22)
InChIKey IBQVOHFPTLHDFM-UHFFFAOYSA-N
Molecular Weight 327.340 g/mol
SMILES N(c1c(cc(c(c1)NCc1ccccc1)N(=O)=O)C(=O)C)C(=O)C
SPLASH splash10-00or-1459000000-cef198a349e3e95a000b
Source of Spectrum J-50-2459-5
Wiley ID 1325471