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1,3,5-Trimethylcyclohexane-1,3,5-tris[N-(2'-hydroxy-1'-phenylethyl)carboxamide]
SpectraBase Compound ID GCUZZi740yr
InChI InChI=1S/C36H45N3O6/c1-34(31(43)37-28(19-40)25-13-7-4-8-14-25)22-35(2,32(44)38-29(20-41)26-15-9-5-10-16-26)24-36(3,23-34)33(45)39-30(21-42)27-17-11-6-12-18-27/h4-18,28-30,40-42H,19-24H2,1-3H3,(H,37,43)(H,38,44)(H,39,45)
InChIKey LXCBANLDUIXDNZ-UHFFFAOYSA-N
Mol Weight 615.8 g/mol
Molecular Formula C36H45N3O6
Exact Mass 615.330836 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2646Aeq0gBf
Name 1,3,5-Trimethylcyclohexane-1,3,5-tris[N-(2'-hydroxy-1'-phenylethyl)carboxamide]
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C36H45N3O6
InChI InChI=1S/C36H45N3O6/c1-34(31(43)37-28(19-40)25-13-7-4-8-14-25)22-35(2,32(44)38-29(20-41)26-15-9-5-10-16-26)24-36(3,23-34)33(45)39-30(21-42)27-17-11-6-12-18-27/h4-18,28-30,40-42H,19-24H2,1-3H3,(H,37,43)(H,38,44)(H,39,45)
InChIKey LXCBANLDUIXDNZ-UHFFFAOYSA-N
Molecular Weight 615.771 g/mol
SMILES N(C(C1(CC(C(NC(CO)c2ccccc2)=O)(CC(C1)(C(NC(CO)c1ccccc1)=O)C)C)C)=O)C(CO)c1ccccc1
SPLASH splash10-00fr-0931900000-83331c419b9b5c82a55a
Source of Spectrum SK-30-1633-3
Wiley ID 881327