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tert-Butyl (2RS,3RS)/(2RS,3SR)-3-(1,3-Benzodioxol-5-yl)-2-(benzylamino)-3-(furan-2-yl)propanoate
SpectraBase Compound ID 2TGgCZmQ7jH
InChI InChI=1S/C25H27NO5/c1-25(2,3)31-24(27)23(26-15-17-8-5-4-6-9-17)22(20-10-7-13-28-20)18-11-12-19-21(14-18)30-16-29-19/h4-14,22-23,26H,15-16H2,1-3H3
InChIKey IFMTTZWDKIWQCL-UHFFFAOYSA-N
Mol Weight 421.49 g/mol
Molecular Formula C25H27NO5
Exact Mass 421.188923 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CK2Jdl9FKm0
Name tert-Butyl (2RS,3RS)/(2RS,3SR)-3-(1,3-Benzodioxol-5-yl)-2-(benzylamino)-3-(furan-2-yl)propanoate
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H27NO5
InChI InChI=1S/C25H27NO5/c1-25(2,3)31-24(27)23(26-15-17-8-5-4-6-9-17)22(20-10-7-13-28-20)18-11-12-19-21(14-18)30-16-29-19/h4-14,22-23,26H,15-16H2,1-3H3
InChIKey IFMTTZWDKIWQCL-UHFFFAOYSA-N
Literature Reference DOI 10.1002/hlca.200790006
Molecular Weight 421.493 g/mol
SMILES N(C(C(c1cc2OCOc2cc1)c1ccco1)C(=O)OC(C)(C)C)Cc1ccccc1
SPLASH splash10-03kc-4940000000-656d9fa60bfb47aac140
Source of Spectrum H-90-140-anti/syn_10d
Synonyms tert-Butyl 3-(benzo[d][1,3]dioxol-5-yl)-2-(benzylamino)-3-(furan-2-yl)propanoate
Wiley ID 1783808