![Acetamide, N-[(5.alpha.,22.beta.,25R)-furostan-26-yl]-](/api/spectrum/EsWq0Zdig7O/structure.png?h=300&w=458 "Acetamide, N-[(5.alpha.,22.beta.,25R)-furostan-26-yl]-")
| SpectraBase Compound ID | 7iKuocZz62a |
|---|---|
| InChI | InChI=1S/C29H49NO2/c1-18(17-30-20(3)31)9-12-25-19(2)27-26(32-25)16-24-22-11-10-21-8-6-7-14-28(21,4)23(22)13-15-29(24,27)5/h18-19,21-27H,6-17H2,1-5H3,(H,30,31)/t18-,19-,21-,22?,23?,24?,25-,26+,27+,28+,29+/m1/s1 |
| InChIKey | QPHDPVYNIHIQSZ-HDZNXGKCSA-N |
| Mol Weight | 443.7 g/mol |
| Molecular Formula | C29H49NO2 |
| Exact Mass | 443.37633 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | EsWq0Zdig7O |
|---|---|
| Name | Acetamide, N-[(5.alpha.,22.beta.,25R)-furostan-26-yl]- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 443.376329820 u |
| Formula | C29H49NO2 |
| InChI | InChI=1S/C29H49NO2/c1-18(17-30-20(3)31)9-12-25-19(2)27-26(32-25)16-24-22-11-10-21-8-6-7-14-28(21,4)23(22)13-15-29(24,27)5/h18-19,21-27H,6-17H2,1-5H3,(H,30,31)/t18-,19-,21-,22?,23?,24?,25-,26+,27+,28+,29+/m1/s1 |
| InChIKey | QPHDPVYNIHIQSZ-HDZNXGKCSA-N |
| Molecular Weight | 443.716 g/mol |
| SMILES | [C@@]12(C(C3CC[C@@]4([C@](C3CC2)(C)CCCC4)[H])C[C@]2([C@@]1([C@@]([C@@](CC[C@](CNC(=O)C)(C)[H])(O2)[H])(C)[H])[H])[H])C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.852985 |