SpectraBase Compound ID | 5aq5f1eYmoS |
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InChI | InChI=1S/C30H50O/c1-23(2)13-11-16-25(4)18-12-17-24(3)14-9-10-15-26(5)21-22-30(8)27(6)19-20-29(31)28(30)7/h13-15,18,27-28H,9-12,16-17,19-22H2,1-8H3/b24-14+,25-18+,26-15+/t27-,28+,30+/m0/s1 |
InChIKey | NCOSIJSSLOKKEM-AJOODFFVSA-N |
Mol Weight | 426.7 g/mol |
Molecular Formula | C30H50O |
Exact Mass | 426.386166 g/mol |
SpectraBase Spectrum ID | Bw5r7fxiF0i |
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Name | MONOCYCLICKETONE |
Compound Number | 18 |
Copyright | Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved. |
InChI | InChI=1S/C30H50O/c1-23(2)13-11-16-25(4)18-12-17-24(3)14-9-10-15-26(5)21-22-30(8)27(6)19-20-29(31)28(30)7/h13-15,18,27-28H,9-12,16-17,19-22H2,1-8H3/b24-14+,25-18+,26-15+/t27-,28+,30+/m0/s1 |
InChIKey | NCOSIJSSLOKKEM-AJOODFFVSA-N |
Literature Reference | I.ABE,M.ROHMER J.CHEM.SOC.PERKIN-1,783(1994) |
Solvent | Chloroform-d |
Technique | 2D - INADEQUATE |