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N-(2-Hydroxyethyl)-N-((E)-2-((Z)-4-methoxybenzylidene)-4-phenylbut-3-en-1-yl)-4-methylbenzenesulfonamide
SpectraBase Compound ID 8pcNmXk5EaA
InChI InChI=1S/C27H29NO4S/c1-22-8-16-27(17-9-22)33(30,31)28(18-19-29)21-25(11-10-23-6-4-3-5-7-23)20-24-12-14-26(32-2)15-13-24/h3-17,20,29H,18-19,21H2,1-2H3/b11-10+,25-20-
InChIKey QZFCKVICZUOEAO-ZSOAJHIHSA-N
Mol Weight 463.59 g/mol
Molecular Formula C27H29NO4S
Exact Mass 463.18173 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CcmXJm87W1o
Name N-(2-Hydroxyethyl)-N-((E)-2-((Z)-4-methoxybenzylidene)-4-phenylbut-3-en-1-yl)-4-methylbenzenesulfonamide
Appearance Colorless oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 463.181729588 u
Formula C27H29NO4S
InChI InChI=1S/C27H29NO4S/c1-22-8-16-27(17-9-22)33(30,31)28(18-19-29)21-25(11-10-23-6-4-3-5-7-23)20-24-12-14-26(32-2)15-13-24/h3-17,20,29H,18-19,21H2,1-2H3/b11-10+,25-20-
InChIKey QZFCKVICZUOEAO-ZSOAJHIHSA-N
Instrument Name LRMS
Ionization Type EI
Literature Reference DOI 10.1002/chem.202203068
Molecular Weight 463.592 g/mol
Reported Formula C27H29NO4S
SMILES OCCN(C\C(=C/C1=CC=C(C=C1)OC)\C=C\C1=CC=CC=C1)S(=O)(=O)C=1C=CC(C)=CC1
SPLASH splash10-0bta-0097400000-78ebea2275b501e22394
Source of Spectrum QE-29-SM72-S7j (DOI: 10.1002/chem.202203068)
Thin-Layer Chromatography 0.52 (50% EtOAc/hexane
Wiley ID 1909476