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Cholestery-2-tetrahydrofuran
SpectraBase Compound ID BZV3jJ4XU7R
InChI InChI=1S/C31H52O2/c1-21(2)8-6-9-22(3)26-13-14-27-25-12-11-23-20-24(33-29-10-7-19-32-29)15-17-30(23,4)28(25)16-18-31(26,27)5/h11,21-22,24-29H,6-10,12-20H2,1-5H3/t22-,24?,25+,26-,27+,28+,29?,30+,31-/m1/s1
InChIKey MATUHGCUPCBENT-ZRZQEUGDSA-N
Mol Weight 456.8 g/mol
Molecular Formula C31H52O2
Exact Mass 456.396731 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID G6rR6wIoWs5
Name Cholestery-2-tetrahydrofuran
Alternate Name(s) 2-[[(8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]oxy]oxolane
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Formula C31H52O2
InChI InChI=1S/C31H52O2/c1-21(2)8-6-9-22(3)26-13-14-27-25-12-11-23-20-24(33-29-10-7-19-32-29)15-17-30(23,4)28(25)16-18-31(26,27)5/h11,21-22,24-29H,6-10,12-20H2,1-5H3/t22-,24?,25+,26-,27+,28+,29?,30+,31-/m1/s1
InChIKey MATUHGCUPCBENT-ZRZQEUGDSA-N
Molecular Weight 456.755 g/mol
SMILES [C@@]12([C@]([C@@]3(CC=C4[C@@]([C@]3(CC2)[H])(CCC(OC2OCCC2)C4)C)[H])(CC[C@@]1([C@@](CCCC(C)C)(C)[H])[H])[H])C
SPLASH splash10-00xr-9007000000-63ac245f795116c8d902
Source of Spectrum KC-57-5999-9
Wiley ID 1625010