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Bis(allyl) [4-(N-tert-butyloxycarbonyl)amino-1H-indol-3-yl]methylphenylacetamidomalonate
SpectraBase Compound ID AODCksTNCYU
InChI InChI=1S/C31H35N3O7/c1-6-16-39-27(36)31(28(37)40-17-7-2,34-25(35)18-21-12-9-8-10-13-21)19-22-20-32-23-14-11-15-24(26(22)23)33-29(38)41-30(3,4)5/h6-15,20,32H,1-2,16-19H2,3-5H3,(H,33,38)(H,34,35)
InChIKey MGCAZOCRQAIAQC-UHFFFAOYSA-N
Mol Weight 561.6 g/mol
Molecular Formula C31H35N3O7
Exact Mass 561.2475 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BRbhZwuSe2Z
Name Bis(allyl) [4-(N-tert-butyloxycarbonyl)amino-1H-indol-3-yl]methylphenylacetamidomalonate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C31H35N3O7
InChI InChI=1S/C31H35N3O7/c1-6-16-39-27(36)31(28(37)40-17-7-2,34-25(35)18-21-12-9-8-10-13-21)19-22-20-32-23-14-11-15-24(26(22)23)33-29(38)41-30(3,4)5/h6-15,20,32H,1-2,16-19H2,3-5H3,(H,33,38)(H,34,35)
InChIKey MGCAZOCRQAIAQC-UHFFFAOYSA-N
Molecular Weight 561.635 g/mol
SMILES N(C(OC(C)(C)C)=O)c1c2c(c[nH]c2ccc1)CC(NC(=O)Cc1ccccc1)(C(=O)OCC=C)C(=O)OCC=C
SPLASH splash10-03di-7000940000-85df29cb907913a62980
Source of Spectrum QE-6-3952-11
Synonyms diallyl 2-({4-[(tert-butoxycarbonyl)amino]-1H-indol-3-yl}methyl)-2-[(phenylacetyl)amino]malonate
Wiley ID 845219