| SpectraBase Compound ID | 4B3On4ozoxU |
|---|---|
| InChI | InChI=1S/C32H46N2O2/c1-20(9-14-30-33-28-7-5-6-8-29(28)34-30)25-12-13-26-24-11-10-22-19-23(36-21(2)35)15-17-31(22,3)27(24)16-18-32(25,26)4/h5-8,20,22-27H,9-19H2,1-4H3,(H,33,34)/t20?,22?,23-,24?,25?,26?,27?,31?,32?/m1/s1 |
| InChIKey | IMTTVOVFFDCCDH-AJVFOKMFSA-N |
| Mol Weight | 490.7 g/mol |
| Molecular Formula | C32H46N2O2 |
| Exact Mass | 490.355929 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 7sldUg0z0OK |
|---|---|
| Name | 3.alpha.-Acetoxy-23-(benzimidazol-2'-yl)nor-cholane |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C32H46N2O2 |
| InChI | InChI=1S/C32H46N2O2/c1-20(9-14-30-33-28-7-5-6-8-29(28)34-30)25-12-13-26-24-11-10-22-19-23(36-21(2)35)15-17-31(22,3)27(24)16-18-32(25,26)4/h5-8,20,22-27H,9-19H2,1-4H3,(H,33,34)/t20?,22?,23-,24?,25?,26?,27?,31?,32?/m1/s1 |
| InChIKey | IMTTVOVFFDCCDH-AJVFOKMFSA-N |
| Molecular Weight | 490.732 g/mol |
| SMILES | [nH]1c2ccccc2nc1CCC(C1C2(C(C3C(C4(C(C[C@](OC(=O)C)(CC4)[H])CC3)C)CC2)CC1)C)C |
| SPLASH | splash10-000t-2900000000-bf13b2f8f5fa08fe9f29 |
| Source of Spectrum | G-60-267-0 |
| Wiley ID | 748934 |