SpectraBase Compound ID | 5Gqbu3pV0qm |
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InChI | InChI=1S/C32H54O2/c1-22(2)12-10-13-24(5)27-17-18-32(9)29-16-15-26(23(3)4)28(14-11-21-34-25(6)33)30(29,7)19-20-31(27,32)8/h12,24,27-29H,10-11,13-21H2,1-9H3/t24?,27-,28+,29-,30-,31-,32+/m0/s1 |
InChIKey | FXXCHJHHOYCYGY-XODLWOJHSA-N |
Mol Weight | 470.8 g/mol |
Molecular Formula | C32H54O2 |
Exact Mass | 470.412381 g/mol |
SpectraBase Spectrum ID | WrMARo4Gl0 |
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Name | Isohelianol - acetate |
Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C32H54O2 |
InChI | InChI=1S/C32H54O2/c1-22(2)12-10-13-24(5)27-17-18-32(9)29-16-15-26(23(3)4)28(14-11-21-34-25(6)33)30(29,7)19-20-31(27,32)8/h12,24,27-29H,10-11,13-21H2,1-9H3/t24?,27-,28+,29-,30-,31-,32+/m0/s1 |
InChIKey | FXXCHJHHOYCYGY-XODLWOJHSA-N |
Molecular Weight | 470.782 g/mol |
SMILES | [C@@]12([C@]([C@](C(CCC=C(C)C)C)(CC2)[H])(CC[C@@]2([C@@]1(CCC(=C(C)C)[C@]2(CCCOC(=O)C)[H])[H])C)C)C |
SPLASH | splash10-014i-9480100000-c6548e1db08680273023 |
Source of Spectrum | G4-61-411-3 |
Wiley ID | 1607190 |