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(S)-methyl 2-((tert-butoxycarbonyl)amino)-3-(2,3-diphenylbenzofuran-5-yl)propanoate
SpectraBase Compound ID KlriYJY1W54
InChI InChI=1S/C29H29NO5/c1-29(2,3)35-28(32)30-23(27(31)33-4)18-19-15-16-24-22(17-19)25(20-11-7-5-8-12-20)26(34-24)21-13-9-6-10-14-21/h5-17,23H,18H2,1-4H3,(H,30,32)/t23-/m0/s1
InChIKey PMEPSXHNDYLCPU-QHCPKHFHSA-N
Mol Weight 471.55 g/mol
Molecular Formula C29H29NO5
Exact Mass 471.204573 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6GWv3IPVM7I
Name (S)-methyl 2-((tert-butoxycarbonyl)amino)-3-(2,3-diphenylbenzofuran-5-yl)propanoate
Alternate Name(s) Methyl (S)-2-((tert-butoxycarbonyl)amino)-3-(2,3-diphenylbenzofuran-5-yl)propanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H29NO5
InChI InChI=1S/C29H29NO5/c1-29(2,3)35-28(32)30-23(27(31)33-4)18-19-15-16-24-22(17-19)25(20-11-7-5-8-12-20)26(34-24)21-13-9-6-10-14-21/h5-17,23H,18H2,1-4H3,(H,30,32)/t23-/m0/s1
InChIKey PMEPSXHNDYLCPU-QHCPKHFHSA-N
Molecular Weight 471.553 g/mol
SMILES N([C@@](Cc1cc2c(c(oc2cc1)-c1ccccc1)-c1ccccc1)(C(OC)=O)[H])C(=O)OC(C)(C)C
SPLASH splash10-00di-0000900000-020f5d0f5c6a4cbe7851
Source of Spectrum ACI-52-SMS22-3s
Wiley ID 1781159