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Bis(1,1-dimethyl-2-phenylethyl) 2,2'-[(Methylimino)bis(propane-3,1-diylcarbamoyl)]dibenzoate
SpectraBase Compound ID CJvopboyrVT
InChI InChI=1S/C43H51N3O6/c1-42(2,30-32-18-8-6-9-19-32)51-40(49)36-24-14-12-22-34(36)38(47)44-26-16-28-46(5)29-17-27-45-39(48)35-23-13-15-25-37(35)41(50)52-43(3,4)31-33-20-10-7-11-21-33/h6-15,18-25H,16-17,26-31H2,1-5H3,(H,44,47)(H,45,48)
InChIKey AOJDDXZQTCEQPT-UHFFFAOYSA-N
Mol Weight 705.9 g/mol
Molecular Formula C43H51N3O6
Exact Mass 705.377786 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2qZgKleQIns
Name Bis(1,1-dimethyl-2-phenylethyl) 2,2'-[(Methylimino)bis(propane-3,1-diylcarbamoyl)]dibenzoate
Alternate Name(s) bis(2-methyl-1-phenylpropan-2-yl) 2,2'-((((methylazanediyl)bis(propane-3,1-diyl))bis(azanediyl))bis(carbonyl))dibenzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C43H51N3O6
InChI InChI=1S/C43H51N3O6/c1-42(2,30-32-18-8-6-9-19-32)51-40(49)36-24-14-12-22-34(36)38(47)44-26-16-28-46(5)29-17-27-45-39(48)35-23-13-15-25-37(35)41(50)52-43(3,4)31-33-20-10-7-11-21-33/h6-15,18-25H,16-17,26-31H2,1-5H3,(H,44,47)(H,45,48)
InChIKey AOJDDXZQTCEQPT-UHFFFAOYSA-N
Literature Reference DOI 10.1002/cbdv.200890217
Molecular Weight 705.896 g/mol
SMILES N(C(c1ccccc1C(OC(Cc1ccccc1)(C)C)=O)=O)CCCN(CCCNC(=O)c1ccccc1C(OC(Cc1ccccc1)(C)C)=O)C
SPLASH splash10-0006-9100000000-9ff26c4983ade1cc0b0b
Source of Spectrum CBD-5-2636-3a
Wiley ID 1790362