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

*Links on SpectraBase are not permalinks.

3,5-Cycloandrostane, (3.beta.,5.alpha.)-

View entire compound with spectra: 2 NMR, and 1 MS (GC)

3,5-Cycloandrostane, (3.beta.,5.alpha.)-
SpectraBase Compound ID GXoTlzM2J17
InChI InChI=1S/C19H30/c1-17-8-3-4-15(17)14-6-11-19-12-13(19)5-10-18(19,2)16(14)7-9-17/h13-16H,3-12H2,1-2H3/t13-,14-,15-,16-,17-,18+,19-/m0/s1
InChIKey CQSSFBCFANSXMM-WRYXYBQESA-N
Mol Weight 258.45 g/mol
Molecular Formula C19H30
Exact Mass 258.234751 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 I4qV82FS9Kn
Name 3,5-Cycloandrostane, (3.beta.,5.alpha.)-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 258.234750966 u
Formula C19H30
InChI InChI=1S/C19H30/c1-17-8-3-4-15(17)14-6-11-19-12-13(19)5-10-18(19,2)16(14)7-9-17/h13-16H,3-12H2,1-2H3/t13-,14-,15-,16-,17-,18+,19-/m0/s1
InChIKey CQSSFBCFANSXMM-WRYXYBQESA-N
Molecular Weight 258.449 g/mol
SMILES [C@@]123[C@@]([C@]4(CC[C@]5([C@]([C@@]4(CC3)[H])(CCC5)[H])C)[H])(CC[C@@]1([H])C2)C