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3,4-Thiophenedicarboxylic acid, 2,2'-(1,4-piperazinediyl)bis[5-phenyl-, tetramethyl ester
SpectraBase Compound ID K0RioNLCMw7
InChI InChI=1S/C32H30N2O8S2/c1-39-29(35)21-23(31(37)41-3)27(43-25(21)19-11-7-5-8-12-19)33-15-17-34(18-16-33)28-24(32(38)42-4)22(30(36)40-2)26(44-28)20-13-9-6-10-14-20/h5-14H,15-18H2,1-4H3
InChIKey GPCNNZXYVPBZSN-UHFFFAOYSA-N
Mol Weight 634.7 g/mol
Molecular Formula C32H30N2O8S2
Exact Mass 634.144358 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4fkC5RyxhaN
Name 3,4-Thiophenedicarboxylic acid, 2,2'-(1,4-piperazinediyl)bis[5-phenyl-, tetramethyl ester
Alternate Name(s) Dimethyl 2-{4-[3,4-bis(methoxycarbonyl)-5-phenyl-2-thienyl]-1-piperazinyl}-5-phenyl-3,4-thiophenedicarboxylate
CAS Registry Number 110699-41-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C32H30N2O8S2
InChI InChI=1S/C32H30N2O8S2/c1-39-29(35)21-23(31(37)41-3)27(43-25(21)19-11-7-5-8-12-19)33-15-17-34(18-16-33)28-24(32(38)42-4)22(30(36)40-2)26(44-28)20-13-9-6-10-14-20/h5-14H,15-18H2,1-4H3
InChIKey GPCNNZXYVPBZSN-UHFFFAOYSA-N
Molecular Weight 634.718 g/mol
SMILES c1(c(c(-c2ccccc2)sc1N1CCN(c2c(c(C(=O)OC)c(s2)-c2ccccc2)C(=O)OC)CC1)C(=O)OC)C(=O)OC
SPLASH splash10-007k-9150007000-48aea7a52a15bfca54a2
Source of Spectrum K-121-320-9
Wiley ID 1412278