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3-METHOXY-5-ALPHA-CHOLEST-2-ENE
SpectraBase Compound ID Cjb8yGzwYj4
InChI InChI=1S/C28H48O/c1-19(2)8-7-9-20(3)24-12-13-25-23-11-10-21-18-22(29-6)14-16-27(21,4)26(23)15-17-28(24,25)5/h14,19-21,23-26H,7-13,15-18H2,1-6H3/t20-,21+,23+,24-,25+,26+,27+,28-/m1/s1
InChIKey NGAMTNOLUXGGQL-GWEYPQJLSA-N
Mol Weight 400.7 g/mol
Molecular Formula C28H48O
Exact Mass 400.370516 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 664e9Pl6wEX
Name 3-METHOXY-5-ALPHA-CHOLEST-2-ENE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C28H48O
InChI InChI=1S/C28H48O/c1-19(2)8-7-9-20(3)24-12-13-25-23-11-10-21-18-22(29-6)14-16-27(21,4)26(23)15-17-28(24,25)5/h14,19-21,23-26H,7-13,15-18H2,1-6H3/t20-,21+,23+,24-,25+,26+,27+,28-/m1/s1
InChIKey NGAMTNOLUXGGQL-GWEYPQJLSA-N
Literature Reference Author V.DAVE,J.B.STOTHERS
Literature Reference Citation CAN.J.CHEM.,57,1550(1979)
Literature Reference DOI 10.1139/v79-253
Molecular Weight 400.689 g/mol
Solvent CDCl3
Source File Reference UWED1621