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3.alpha.-(N-Methylamino)-5.alpha.-ergosta-7,22-diene
SpectraBase Compound ID AEY2p6YIFz8
InChI InChI=1S/C29H49N/c1-19(2)20(3)8-9-21(4)25-12-13-26-24-11-10-22-18-23(30-7)14-16-28(22,5)27(24)15-17-29(25,26)6/h8-9,11,19-23,25-27,30H,10,12-18H2,1-7H3/b9-8+/t20-,21?,22+,23-,25-,26+,27+,28+,29-/m1/s1
InChIKey KGOHWUCDOBGHCJ-VGXBTIFXSA-N
Mol Weight 411.7 g/mol
Molecular Formula C29H49N
Exact Mass 411.386501 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EoCk10BumTr
Name 3-ALPHA-(N-METHYLAMINO)-5-ALPHA-ERGOSTA-7,22-DIENE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C29H49N
InChI InChI=1S/C29H49N/c1-19(2)20(3)8-9-21(4)25-12-13-26-24-11-10-22-18-23(30-7)14-16-28(22,5)27(24)15-17-29(25,26)6/h8-9,11,19-23,25-27,30H,10,12-18H2,1-7H3/b9-8+/t20-,21?,22+,23-,25-,26+,27+,28+,29-/m1/s1
InChIKey KGOHWUCDOBGHCJ-VGXBTIFXSA-N
Literature Reference Author R.M.ROSSER,D.J.FAULKNER
Literature Reference Citation J.ORG.CHEM.,49,5157(1984)
Literature Reference DOI 10.1021/jo00200a029
Molecular Weight 411.715 g/mol
Solvent CDCl3
Source File Reference UNIW17276