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CB-86

View entire compound with spectra: 1 MS (GC)

CB-86
SpectraBase Compound ID 9LVCuoT06rL
InChI InChI=1S/C26H43NO3/c1-4-5-6-11-16-26(2,3)21-18-23(28)20-24(19-21)30-17-12-9-7-8-10-13-25(29)27-22-14-15-22/h18-20,22,28H,4-17H2,1-3H3,(H,27,29)
InChIKey PVAOGZXUOOHSMN-UHFFFAOYSA-N
Mol Weight 417.6 g/mol
Molecular Formula C26H43NO3
Exact Mass 417.324294 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1YXTBmrGt7N
Name CB-86
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H43NO3
InChI InChI=1S/C26H43NO3/c1-4-5-6-11-16-26(2,3)21-18-23(28)20-24(19-21)30-17-12-9-7-8-10-13-25(29)27-22-14-15-22/h18-20,22,28H,4-17H2,1-3H3,(H,27,29)
InChIKey PVAOGZXUOOHSMN-UHFFFAOYSA-N
Molecular Weight 417.634 g/mol
SMILES Oc1cc(cc(OCCCCCCCC(=O)NC2CC2)c1)C(CCCCCC)(C)C
SPLASH splash10-0a4i-9401000000-21ad16a0a15c841b31f6
Source of Spectrum SWG-33-3292-0
Synonyms N-cyclopropyl-8-[3(1,1-dimethylheptyl)-5-hydroxyphenoxy}-octanamide N-cyclopropyl-8-(3-hydroxy-5-(2-methyloctan-2-yl)phenoxy)octanamide
Wiley ID 1810150