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9-ALPHA-11-EPOXY-5-ALPHA-ERGOSTA-7,22-DIEN-3-BETA-YL-ACETAT
SpectraBase Compound ID Jecl9y70MCw
InChI InChI=1S/C30H46O3/c1-18(2)19(3)8-9-20(4)24-12-13-25-26-11-10-22-16-23(32-21(5)31)14-15-29(22,7)30(26)27(33-30)17-28(24,25)6/h8-9,11,18-20,22-25,27H,10,12-17H2,1-7H3/b9-8+/t19?,20-,22+,23+,24-,25+,27-,28-,29+,30+/m1/s1
InChIKey ZEXMJPXGJRWQQK-RBVGHPEBSA-N
Mol Weight 454.7 g/mol
Molecular Formula C30H46O3
Exact Mass 454.344695 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9C77Jfdmyn9
Name 9-ALPHA-11-EPOXY-5-ALPHA-ERGOSTA-7,22-DIEN-3-BETA-YL-ACETAT
Compound Number 283
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H46O3
InChI InChI=1S/C30H46O3/c1-18(2)19(3)8-9-20(4)24-12-13-25-26-11-10-22-16-23(32-21(5)31)14-15-29(22,7)30(26)27(33-30)17-28(24,25)6/h8-9,11,18-20,22-25,27H,10,12-17H2,1-7H3/b9-8+/t19?,20-,22+,23+,24-,25+,27-,28-,29+,30+/m1/s1
InChIKey ZEXMJPXGJRWQQK-RBVGHPEBSA-N
Literature Reference Author J.W.BLUNT,J.B.STOTHERS
Literature Reference Citation ORG.MAGN.RES.,9,439(1977)
Literature Reference DOI 10.1002/mrc.1270090802
Molecular Weight 454.693 g/mol
Solvent CDCl3
Source File Reference UNIW3372