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1,2-bis{4'-[.alpha.-Methylbenzyl)aminocarbonyl]-2',3'-dihydroxyphenyl]-ethane
SpectraBase Compound ID CtnNH3bZGf
InChI InChI=1S/C32H32N2O6/c1-19(21-9-5-3-6-10-21)33-31(39)25-17-15-23(27(35)29(25)37)13-14-24-16-18-26(30(38)28(24)36)32(40)34-20(2)22-11-7-4-8-12-22/h3-12,15-20,35-38H,13-14H2,1-2H3,(H,33,39)(H,34,40)/t19-,20-/m0/s1
InChIKey VBXNLTJFUXEJSO-PMACEKPBSA-N
Mol Weight 540.6 g/mol
Molecular Formula C32H32N2O6
Exact Mass 540.226037 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HIx2jY2GQgD
Name 1,2-bis{4'-[.alpha.-Methylbenzyl)aminocarbonyl]-2',3'-dihydroxyphenyl]-ethane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C32H32N2O6
InChI InChI=1S/C32H32N2O6/c1-19(21-9-5-3-6-10-21)33-31(39)25-17-15-23(27(35)29(25)37)13-14-24-16-18-26(30(38)28(24)36)32(40)34-20(2)22-11-7-4-8-12-22/h3-12,15-20,35-38H,13-14H2,1-2H3,(H,33,39)(H,34,40)/t19-,20-/m0/s1
InChIKey VBXNLTJFUXEJSO-PMACEKPBSA-N
Molecular Weight 540.616 g/mol
SMILES N(C(c1ccc(CCc2ccc(c(c2O)O)C(N[C@](c2ccccc2)(C)[H])=O)c(c1O)O)=O)[C@](c1ccccc1)(C)[H]
SPLASH splash10-0a4i-0903040000-0ca117de4f23cf95944a
Source of Spectrum D1-1996-567-4
Wiley ID 834767