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27-Norergost-5-en-3-ol, 24-methyl-23-methylene-, (3.beta.)-
SpectraBase Compound ID 2Ue2ybH5Ipo
InChI InChI=1S/C29H48O/c1-8-27(4,5)20(3)17-19(2)24-11-12-25-23-10-9-21-18-22(30)13-15-28(21,6)26(23)14-16-29(24,25)7/h9,19,22-26,30H,3,8,10-18H2,1-2,4-7H3/t19-,22+,23+,24-,25+,26+,28+,29-/m1/s1
InChIKey XTKDIMZRBCMMJJ-HSIBUNQISA-N
Mol Weight 412.7 g/mol
Molecular Formula C29H48O
Exact Mass 412.370516 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JBUrcNVGYmQ
Name 27-Norergost-5-en-3-ol, 24-methyl-23-methylene-, (3.beta.)-
Alternate Name(s) (1S,2R,5S,10S,11S,14R,15R)-14-[(2R)-5,5-dimethyl-4-methylideneheptan-2-yl]-2,15-dimethyltetracyclo[8.7.0.0(2,7).0(11,15)]heptadec-7-en-5-ol 23-Methylene-24-methyl-27-norergost-5-en-3.beta.-ol
CAS Registry Number 117775-24-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H48O
InChI InChI=1S/C29H48O/c1-8-27(4,5)20(3)17-19(2)24-11-12-25-23-10-9-21-18-22(30)13-15-28(21,6)26(23)14-16-29(24,25)7/h9,19,22-26,30H,3,8,10-18H2,1-2,4-7H3/t19-,22+,23+,24-,25+,26+,28+,29-/m1/s1
InChIKey XTKDIMZRBCMMJJ-HSIBUNQISA-N
Molecular Weight 412.702 g/mol
SMILES O[C@]1(CC[C@@]2([C@]3(CC[C@]4([C@]([C@@]3(CC=C2C1)[H])(CC[C@@]4([C@@](CC(C(CC)(C)C)=C)(C)[H])[H])[H])C)[H])C)[H]
SPLASH splash10-0uxr-0094000000-5fce71413c53ad0b631b
Source of Spectrum J-53-5902-21
Wiley ID 1374809