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N,N-Dibenzyl-14,19-dihydroxyundecacyclo-icosane-4,9-dicarboxamide
SpectraBase Compound ID CqXuA9nAyo
InChI InChI=1S/C36H34N2O4/c39-29-25-17-18-26(29)34-22-16-15-21(19(22)31(41)37-11-13-7-3-1-4-8-13)33(25,34)35-23(15)20(32(42)38-12-14-9-5-2-6-10-14)24(16)36(34,35)28(18)30(40)27(17)35/h1-10,15-30,39-40H,11-12H2,(H,37,41)(H,38,42)
InChIKey WNRWMQJTQHOHEC-UHFFFAOYSA-N
Mol Weight 558.7 g/mol
Molecular Formula C36H34N2O4
Exact Mass 558.251858 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5Tj0Ofpt89x
Name N,N-Dibenzyl-14,19-dihydroxyundecacyclo-icosane-4,9-dicarboxamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C36H34N2O4
InChI InChI=1S/C36H34N2O4/c39-29-25-17-18-26(29)34-22-16-15-21(19(22)31(41)37-11-13-7-3-1-4-8-13)33(25,34)35-23(15)20(32(42)38-12-14-9-5-2-6-10-14)24(16)36(34,35)28(18)30(40)27(17)35/h1-10,15-30,39-40H,11-12H2,(H,37,41)(H,38,42)
InChIKey WNRWMQJTQHOHEC-UHFFFAOYSA-N
Molecular Weight 558.678 g/mol
SMILES N(C(C1C2C34C56C7C(C8C66C4(C1C1C2C5C(C61)C(NCc1ccccc1)=O)C1C(C3C7C81)O)O)=O)Cc1ccccc1
SPLASH splash10-0006-9201100000-c0e06bf0ebf1b1006f00
Source of Spectrum U-1997-2081-16
Synonyms N(4),N(9)-dibenzyl-14,19-dihydroxyundecacyclo[9.9.0.0(1,5).0(2,12).0(2,18).0(3,7).0(6,10).0(8,12).0(11,15).0(13,17).0(16,20)]icosane-4,9-dicarboxamide
Wiley ID 770373