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Ethyl (4E)-5-(4-Cyanophenyl)-5-(4-methoxyphenyl)-4-[(4-methoxyphenyl)thio]-2-methylenepent-4-enoate
SpectraBase Compound ID Ih9cxLfwuF2
InChI InChI=1S/C29H27NO4S/c1-5-34-29(31)20(2)18-27(35-26-16-14-25(33-4)15-17-26)28(22-8-6-21(19-30)7-9-22)23-10-12-24(32-3)13-11-23/h6-17H,2,5,18H2,1,3-4H3/b28-27+
InChIKey DDCPUWBTGFFMOE-BYYHNAKLSA-N
Mol Weight 485.6 g/mol
Molecular Formula C29H27NO4S
Exact Mass 485.16608 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AjRouziI7QD
Name Ethyl (4E)-5-(4-Cyanophenyl)-5-(4-methoxyphenyl)-4-[(4-methoxyphenyl)thio]-2-methylenepent-4-enoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H27NO4S
InChI InChI=1S/C29H27NO4S/c1-5-34-29(31)20(2)18-27(35-26-16-14-25(33-4)15-17-26)28(22-8-6-21(19-30)7-9-22)23-10-12-24(32-3)13-11-23/h6-17H,2,5,18H2,1,3-4H3/b28-27+
InChIKey DDCPUWBTGFFMOE-BYYHNAKLSA-N
Molecular Weight 485.598 g/mol
SMILES c1(\C(=C/(CC(C(=O)OCC)=C)Sc2ccc(OC)cc2)c2ccc(C#N)cc2)ccc(cc1)OC
SPLASH splash10-00ks-0109600000-1cdbc6f551f6d4d9d67d
Source of Spectrum F4-43-3460-6m
Wiley ID 1690575