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7,12-Dioxo-3α-hydroxy-5β-chloan-24-oic acid, methyl ester, ethyl carbonate
SpectraBase Compound ID Km6EZ46R6Fg
InChI InChI=1S/C28H44O6/c1-6-33-26(31)34-19-13-14-27(3)18(15-19)8-9-20-22-11-10-21(17(2)7-12-25(30)32-5)28(22,4)24(29)16-23(20)27/h17-23H,6-16H2,1-5H3/t17-,18-,19-,20+,21-,22+,23+,27+,28-/m1/s1
InChIKey IIKAPKMDLLYVKL-XBBAIHCVSA-N
Mol Weight 476.7 g/mol
Molecular Formula C28H44O6
Exact Mass 476.313789 g/mol

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CFzhB36NxZR
Name 7,12-Dioxo-3α-hydroxy-5β-chloan-24-oic acid, methyl ester, ethyl carbonate
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Formula C28H44O6
InChI InChI=1S/C28H44O6/c1-6-33-26(31)34-19-13-14-27(3)18(15-19)8-9-20-22-11-10-21(17(2)7-12-25(30)32-5)28(22,4)24(29)16-23(20)27/h17-23H,6-16H2,1-5H3/t17-,18-,19-,20+,21-,22+,23+,27+,28-/m1/s1
InChIKey IIKAPKMDLLYVKL-XBBAIHCVSA-N
Instrument Name Varian CFT-20
Sadtler NMR Number 52951M
Solvent CDCl3