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9,10-Secoergosta-5,7,22-trien-3-ol, (3.beta.,5E,7E,10.alpha.,22E)-

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9,10-Secoergosta-5,7,22-trien-3-ol, (3.beta.,5E,7E,10.alpha.,22E)-
SpectraBase Compound ID LDEDaPVKsOb
InChI InChI=1S/C28H46O/c1-19(2)20(3)9-10-22(5)26-15-16-27-23(8-7-17-28(26,27)6)12-13-24-18-25(29)14-11-21(24)4/h9-10,12-13,19-22,25-27,29H,7-8,11,14-18H2,1-6H3/b10-9+,23-12+,24-13+
InChIKey ILYCWAKSDCYMBB-ZJGOHBTISA-N
Mol Weight 398.7 g/mol
Molecular Formula C28H46O
Exact Mass 398.354866 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AZIfmsVqf7i
Name Epi-dihydro-tachysterol-2
CAS Registry Number 62777-58-6
Comments DIFFERENTIAL SHIFTS OF P-NITRO-BENZOATE REPORTED
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C28H46O
InChI InChI=1S/C28H46O/c1-19(2)20(3)9-10-22(5)26-15-16-27-23(8-7-17-28(26,27)6)12-13-24-18-25(29)14-11-21(24)4/h9-10,12-13,19-22,25-27,29H,7-8,11,14-18H2,1-6H3/b10-9+,23-12+,24-13+
InChIKey ILYCWAKSDCYMBB-ZJGOHBTISA-N
Instrument Name Varian CFT-20
Literature Reference E. Berman, Z. Luz, Y. Mazur, J. Org. Chem. 42, 3325 (1977).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3