![3'-.Epsilon.-acetoxy-spiro[cholestane-3,1'-cyclobutane]](/api/spectrum/KwTXslZU43p/structure.png?h=300&w=458 "3'-.Epsilon.-acetoxy-spiro[cholestane-3,1'-cyclobutane]")
| SpectraBase Compound ID | IBRxLRJPgqD |
|---|---|
| InChI | InChI=1S/C32H54O2/c1-21(2)8-7-9-22(3)27-12-13-28-26-11-10-24-18-32(19-25(20-32)34-23(4)33)17-16-30(24,5)29(26)14-15-31(27,28)6/h21-22,24-29H,7-20H2,1-6H3/t22-,24+,25?,26?,27-,28?,29?,30+,31-,32?/m1/s1 |
| InChIKey | URFMOOHCFBVTLA-FALZXGLRSA-N |
| Mol Weight | 470.8 g/mol |
| Molecular Formula | C32H54O2 |
| Exact Mass | 470.412381 g/mol |
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 | KwTXslZU43p |
|---|---|
| Name | 3'-.Epsilon.-acetoxy-spiro[cholestane-3,1'-cyclobutane] |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 470.412380977 u |
| Formula | C32H54O2 |
| InChI | InChI=1S/C32H54O2/c1-21(2)8-7-9-22(3)27-12-13-28-26-11-10-24-18-32(19-25(20-32)34-23(4)33)17-16-30(24,5)29(26)14-15-31(27,28)6/h21-22,24-29H,7-20H2,1-6H3/t22-,24+,25?,26?,27-,28?,29?,30+,31-,32?/m1/s1 |
| InChIKey | URFMOOHCFBVTLA-FALZXGLRSA-N |
| Molecular Weight | 470.782 g/mol |
| SMILES | [C@]12(C(C3C([C@@]4([C@@](CC5(CC(C5)OC(=O)C)CC4)([H])CC3)C)CC1)CC[C@@]2([C@@](CCCC(C)C)(C)[H])[H])C |