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3.beta.,28-Dihydroxy-12-ursene
SpectraBase Compound ID FvtnP8rK4De
InChI InChI=1S/C30H50O2/c1-19-10-15-30(18-31)17-16-28(6)21(25(30)20(19)2)8-9-23-27(5)13-12-24(32)26(3,4)22(27)11-14-29(23,28)7/h8,19-20,22-25,31-32H,9-18H2,1-7H3/t19-,20-,22?,23-,24?,25-,27?,28-,29+,30+/m1/s1
InChIKey XUARCIYIVXVTAE-BKGGSFIVSA-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 4Spjb6hDGHd
Name 3.beta.,28-Dihydroxy-12-ursene
CAS Registry Number 545-46-0
Comments broad-band decoupling (BB)
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Formula C30H50O2
InChI InChI=1S/C30H50O2/c1-19-10-15-30(18-31)17-16-28(6)21(25(30)20(19)2)8-9-23-27(5)13-12-24(32)26(3,4)22(27)11-14-29(23,28)7/h8,19-20,22-25,31-32H,9-18H2,1-7H3/t19-,20-,22?,23-,24?,25-,27?,28-,29+,30+/m1/s1
InChIKey XUARCIYIVXVTAE-BKGGSFIVSA-N
Instrument Name SF = 300 MHz
Literature Reference J. Nat. Products 49, 1086 (1986).
NMR Standard not reported
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3