![1' H-5.alpha.-Cholest-2-eno[3,2-b]indole](/api/spectrum/B4NGgjnacEq/structure.png?h=300&w=458 "1' H-5.alpha.-Cholest-2-eno[3,2-b]indole")
| SpectraBase Compound ID | DvgjurD7BJC |
|---|---|
| InChI | InChI=1S/C33H49N/c1-21(2)9-8-10-22(3)27-15-16-28-25-14-13-23-19-31-26(24-11-6-7-12-30(24)34-31)20-33(23,5)29(25)17-18-32(27,28)4/h6-7,11-12,21-23,25,27-29,34H,8-10,13-20H2,1-5H3/t22-,23?,25+,27-,28+,29+,32-,33+/m1/s1 |
| InChIKey | UJPMSSIEJPGKGY-VZNWBHMVSA-N |
| Mol Weight | 459.8 g/mol |
| Molecular Formula | C33H49N |
| Exact Mass | 459.386501 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | B4NGgjnacEq |
|---|---|
| Name | 1' H-5.alpha.-Cholest-2-eno[3,2-b]indole |
| Comments | Less than 3 mono-isotopic peaks |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C33H49N |
| InChI | InChI=1S/C33H49N/c1-21(2)9-8-10-22(3)27-15-16-28-25-14-13-23-19-31-26(24-11-6-7-12-30(24)34-31)20-33(23,5)29(25)17-18-32(27,28)4/h6-7,11-12,21-23,25,27-29,34H,8-10,13-20H2,1-5H3/t22-,23?,25+,27-,28+,29+,32-,33+/m1/s1 |
| InChIKey | UJPMSSIEJPGKGY-VZNWBHMVSA-N |
| Molecular Weight | 459.762 g/mol |
| SMILES | [nH]1c2ccccc2c2c1CC1CC[C@@]3([C@@]([C@]1(C2)C)(CC[C@@]1([C@](CC[C@@]31[H])([C@@](CCCC(C)C)(C)[H])[H])C)[H])[H] |
| SPLASH | splash10-052f-0800900000-325ef5f9c20ca0560520 |
| Source of Spectrum | U-1993-1226-1 |
| Wiley ID | 765478 |