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27-Norergosta-5,22-dien-3-ol, (3.beta.,22Z)-

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27-Norergosta-5,22-dien-3-ol, (3.beta.,22Z)-
SpectraBase Compound ID Ek5udsfz5hi
InChI InChI=1S/C27H44O/c1-6-18(2)7-8-19(3)23-11-12-24-22-10-9-20-17-21(28)13-15-26(20,4)25(22)14-16-27(23,24)5/h7-9,18-19,21-25,28H,6,10-17H2,1-5H3/b8-7-
InChIKey UBEHHDQAQBJTAE-FPLPWBNLSA-N
Mol Weight 384.6 g/mol
Molecular Formula C27H44O
Exact Mass 384.339216 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Ev9xJPHN4hp
Name 27-Norergosta-5,22-dien-3-ol, (3.beta.,22Z)-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 384.339216036 u
Formula C27H44O
InChI InChI=1S/C27H44O/c1-6-18(2)7-8-19(3)23-11-12-24-22-10-9-20-17-21(28)13-15-26(20,4)25(22)14-16-27(23,24)5/h7-9,18-19,21-25,28H,6,10-17H2,1-5H3/b8-7-
InChIKey UBEHHDQAQBJTAE-FPLPWBNLSA-N
Molecular Weight 384.648 g/mol
SMILES CCC(C)\C=C/C(C)C1CCC2C3CC=C4CC(O)CCC4(C)C3CCC12C