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N-Ethynyl-N-{2-[(Z)-pent-3-en-1-ynyl]phenyl}-tosylamide

View entire compound with spectra: 1 NMR, and 1 MS (GC)

N-Ethynyl-N-{2-[(Z)-pent-3-en-1-ynyl]phenyl}-tosylamide
SpectraBase Compound ID 3uMUAMnpAfj
InChI InChI=1S/C20H17NO2S/c1-4-6-7-10-18-11-8-9-12-20(18)21(5-2)24(22,23)19-15-13-17(3)14-16-19/h2,4,6,8-9,11-16H,1,3H3/b6-4-
InChIKey QIHVRXWWWNZLTO-XQRVVYSFSA-N
Mol Weight 335.42 g/mol
Molecular Formula C20H17NO2S
Exact Mass 335.098 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FzVoLpfbvUf
Name N-Ethynyl-N-{2-[(Z)-pent-3-en-1-ynyl]phenyl}-tosylamide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 335.097999963 u
Formula C20H17NO2S
InChI InChI=1S/C20H17NO2S/c1-4-6-7-10-18-11-8-9-12-20(18)21(5-2)24(22,23)19-15-13-17(3)14-16-19/h2,4,6,8-9,11-16H,1,3H3/b6-4-
InChIKey QIHVRXWWWNZLTO-XQRVVYSFSA-N
Molecular Weight 335.421 g/mol
SMILES C=1(N(S(C2=CC=C(C=C2)C)(=O)=O)C#C)C(C#C\C=C/C)=CC=CC1