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tert-Butyl 3-(anthracene-9-sulfonamido)-3-(4-cyanophenyl)propanoate
SpectraBase Compound ID 4jdczPiDlE4
InChI InChI=1S/C28H26N2O4S/c1-28(2,3)34-26(31)17-25(20-14-12-19(18-29)13-15-20)30-35(32,33)27-23-10-6-4-8-21(23)16-22-9-5-7-11-24(22)27/h4-16,25,30H,17H2,1-3H3
InChIKey GZMGWMYPHKREIO-UHFFFAOYSA-N
Mol Weight 486.59 g/mol
Molecular Formula C28H26N2O4S
Exact Mass 486.161328 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FlC43jdSQyI
Name tert-Butyl 3-(anthracene-9-sulfonamido)-3-(4-cyanophenyl)propanoate
Alternate Name(s) tert-Butyl 3-[(9-anthrylsulfonyl)amino]-3-(4-cyanophenyl)propanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H26N2O4S
InChI InChI=1S/C28H26N2O4S/c1-28(2,3)34-26(31)17-25(20-14-12-19(18-29)13-15-20)30-35(32,33)27-23-10-6-4-8-21(23)16-22-9-5-7-11-24(22)27/h4-16,25,30H,17H2,1-3H3
InChIKey GZMGWMYPHKREIO-UHFFFAOYSA-N
Molecular Weight 486.586 g/mol
SMILES N(S(c1c2c(cccc2)cc2c1cccc2)(=O)=O)C(CC(OC(C)(C)C)=O)c1ccc(C#N)cc1
SPLASH splash10-004i-0900000000-0d0176a55f5758dfab81
Source of Spectrum F-49-11338-8
Wiley ID 789023