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N-[2-[(1E)-1-ethoxybuta-1,3-dienyl]phenyl]acetamide
SpectraBase Compound ID EnpflqQtYFL
InChI InChI=1S/C14H17NO2/c1-4-8-14(17-5-2)12-9-6-7-10-13(12)15-11(3)16/h4,6-10H,1,5H2,2-3H3,(H,15,16)/b14-8+
InChIKey XBPTWAJAYQKTBR-RIYZIHGNSA-N
Mol Weight 231.29 g/mol
Molecular Formula C14H17NO2
Exact Mass 231.125929 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID FiVHNOoxWyy
Name N-[2-[(1E)-1-Ethoxybuta-1,3-dienyl]phenyl]acetamide
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 231.125928789 u
Formula C14H17NO2
InChI InChI=1S/C14H17NO2/c1-4-8-14(17-5-2)12-9-6-7-10-13(12)15-11(3)16/h4,6-10H,1,5H2,2-3H3,(H,15,16)/b14-8+
InChIKey XBPTWAJAYQKTBR-RIYZIHGNSA-N
Molecular Weight 231.295 g/mol
SMILES C=1(C(NC(=O)C)=CC=CC1)\C(=C/C=C)OCC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.841177