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22-Hydroxyhopan-1-one

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22-Hydroxyhopan-1-one
SpectraBase Compound ID IiSQIFTfQ5B
InChI InChI=1S/C30H50O2/c1-25(2)15-14-24(31)30(8)21(25)13-18-29(7)23(30)10-9-22-27(5)16-11-19(26(3,4)32)20(27)12-17-28(22,29)6/h19-23,32H,9-18H2,1-8H3/t19-,20-,21-,22+,23-,27-,28+,29+,30-/m0/s1
InChIKey OFMYBLNHEMHCAO-KRGADYIYSA-N
Mol Weight 442.7 g/mol
Molecular Formula C30H50O2
Exact Mass 442.381081 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9rbIfqISBUH
Name 22-HYDROXYHOPAN-1-ONE
Compound Number 6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H50O2
InChI InChI=1S/C30H50O2/c1-25(2)15-14-24(31)30(8)21(25)13-18-29(7)23(30)10-9-22-27(5)16-11-19(26(3,4)32)20(27)12-17-28(22,29)6/h19-23,32H,9-18H2,1-8H3/t19-,20-,21-,22+,23-,27-,28+,29+,30-/m0/s1
InChIKey OFMYBLNHEMHCAO-KRGADYIYSA-N
Literature Reference Author N.TANAKA,H.WADA,M.KOJIMA,T.MURAKAMI,Y.SAIKI,C.-M.CHEN,Y.IITA KA
Literature Reference Citation CHEM.PHARM.BULL.,35,4016(1987)
Literature Reference DOI 10.1248/cpb.35.4016
Molecular Weight 442.726 g/mol
Solvent CDCl3
Source File Reference UWBK113