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2-[(4-Methoxybenzylidene)hydrazino]-2-oxo-N-propylacetamide
SpectraBase Compound ID L5FKWC4XHSB
InChI InChI=1S/C13H17N3O3/c1-3-8-14-12(17)13(18)16-15-9-10-4-6-11(19-2)7-5-10/h4-7,9H,3,8H2,1-2H3,(H,14,17)(H,16,18)/b15-9+
InChIKey MRPKLLSUWDZGKG-OQLLNIDSSA-N
Mol Weight 263.3 g/mol
Molecular Formula C13H17N3O3
Exact Mass 263.126991 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID Pv901BFCen
Name 2-[(4-Methoxybenzylidene)hydrazino]-2-oxo-N-propylacetamide
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 263.126991416 u
Formula C13H17N3O3
InChI InChI=1S/C13H17N3O3/c1-3-8-14-12(17)13(18)16-15-9-10-4-6-11(19-2)7-5-10/h4-7,9H,3,8H2,1-2H3,(H,14,17)(H,16,18)/b15-9+
InChIKey MRPKLLSUWDZGKG-OQLLNIDSSA-N
Molecular Weight 263.297 g/mol
SMILES C(C(=O)NCCC)(N\N=C\C1=CC=C(OC)C=C1)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.925315