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[1-13C]-(E)-4-(benzyloxy)-N-methoxy-N-methylbut-2-enamide
SpectraBase Compound ID 4yekxcK9eB9
InChI InChI=1S/C13H17NO3/c1-14(16-2)13(15)9-6-10-17-11-12-7-4-3-5-8-12/h3-9H,10-11H2,1-2H3/b9-6+/i13+1
InChIKey WYSHSQOVGHFWFF-PHLKGZLDSA-N
Mol Weight 236.28 g/mol
Molecular Formula C1213CH17NO3
Exact Mass 236.124198 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1TrIZ0b7DXa
Name [1-13C]-(E)-4-(benzyloxy)-N-methoxy-N-methylbut-2-enamide
Comments Original formula: C12[13C]H17NO3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H17NO3
InChI InChI=1S/C13H17NO3/c1-14(16-2)13(15)9-6-10-17-11-12-7-4-3-5-8-12/h3-9H,10-11H2,1-2H3/b9-6+/i13+1
InChIKey WYSHSQOVGHFWFF-PHLKGZLDSA-N
Literature Reference DOI 10.1039/c4cc00177j
Molecular Weight 236.275 g/mol
SMILES CON([13C](\C=C\COCc1ccccc1)=O)C
SPLASH splash10-0006-9200000000-ac1220a3cc67dafbb2b1
Source of Spectrum KD-50-4228/SMS13-6a
Wiley ID 1754456