For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

3.beta.,22E-Stigmasta-5,22-dien-3-ol, flophemesyl ether

View entire compound with spectra: 1 NMR

3.beta.,22E-Stigmasta-5,22-dien-3-ol, flophemesyl ether
SpectraBase Compound ID 1NKMjlKHJbb
InChI InChI=1S/C37H53F5OSi/c1-9-23(21(2)3)11-10-22(4)27-14-15-28-26-13-12-24-20-25(16-18-36(24,5)29(26)17-19-37(27,28)6)43-44(7,8)35-33(41)31(39)30(38)32(40)34(35)42/h10-12,21-23,25-29H,9,13-20H2,1-8H3/b11-10-
InChIKey OYGKIQPTFDLMEU-KHPPLWFESA-N
Mol Weight 636.9 g/mol
Molecular Formula C37H53F5OSi
Exact Mass 636.378584 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 60XHutznqmL
Name 3.beta.,22E-Stigmasta-5,22-dien-3-ol, flophemesyl ether
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 636.378583676 u
Formula C37H53F5OSi
InChI InChI=1S/C37H53F5OSi/c1-9-23(21(2)3)11-10-22(4)27-14-15-28-26-13-12-24-20-25(16-18-36(24,5)29(26)17-19-37(27,28)6)43-44(7,8)35-33(41)31(39)30(38)32(40)34(35)42/h10-12,21-23,25-29H,9,13-20H2,1-8H3/b11-10-
InChIKey OYGKIQPTFDLMEU-KHPPLWFESA-N
Molecular Weight 636.907 g/mol
SMILES C12(CCC(CC2=CCC2C1CCC1(C2CCC1C(\C=C/C(C(C)C)CC)C)C)O[Si](C)(C)C1=C(C(=C(C(=C1F)F)F)F)F)C