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Isohelianol - acetate
SpectraBase Compound ID 5Gqbu3pV0qm
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

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID WrMARo4Gl0
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