| SpectraBase Compound ID | LwL45WXaN0T |
|---|---|
| InChI | InChI=1S/C22H30O4/c1-13(23)26-15-8-10-21(2)14(12-15)4-5-16-17-6-7-19(20(24)25)22(17,3)11-9-18(16)21/h4,7,15-18H,5-6,8-12H2,1-3H3,(H,24,25)/t15-,16?,17?,18?,21-,22-/m0/s1 |
| InChIKey | XTINFMPTFDILCU-QHRGDQGKSA-N |
| Mol Weight | 358.48 g/mol |
| Molecular Formula | C22H30O4 |
| Exact Mass | 358.214409 g/mol |
Transmission Infrared (IR) Spectrum
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| SpectraBase Spectrum ID | BEcuBQTorA3 |
|---|---|
| Name | 5,16-Androstadien-3β-ol-17β-carboxylic acid 3-acetate |
| Source of Sample | Steraloids Inc. |
| Catalog Number | A0681-000 |
| Lot Number | 1989 |
| Copyright | Copyright © 2012-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C22H30O4 |
| InChI | InChI=1S/C22H30O4/c1-13(23)26-15-8-10-21(2)14(12-15)4-5-16-17-6-7-19(20(24)25)22(17,3)11-9-18(16)21/h4,7,15-18H,5-6,8-12H2,1-3H3,(H,24,25)/t15-,16?,17?,18?,21-,22-/m0/s1 |
| InChIKey | XTINFMPTFDILCU-QHRGDQGKSA-N |
| Instrument Name | Bio-Rad FTS |
| Molecular Weight | 358.478 g/mol |
| SMILES | OC(\C1=C\CC2C3C\C=C\4C[C@](CC[C@@]4(C3CC[C@]12C)C)(OC(C)=O)[H])=O |
| Source of Spectrum | Forensic Spectral Research |
| Synonyms | Etiadienic acid 3-acetate |
| Technique | KBr1 |