| SpectraBase Compound ID | 2pzKEn6q4Hj |
|---|---|
| InChI | InChI=1S/C27H42O3/c1-5-6-7-8-9-25(29)30-24-13-12-22-21-11-10-19-17-20(28)16-18(2)27(19,4)23(21)14-15-26(22,24)3/h16,19,21-24H,5-15,17H2,1-4H3/t19-,21-,22-,23-,24-,26-,27-/m0/s1 |
| InChIKey | TXUICONDJPYNPY-FRXWOFFRSA-N |
| Mol Weight | 414.6 g/mol |
| Molecular Formula | C27H42O3 |
| Exact Mass | 414.313395 g/mol |
Attenuated Total Reflectance Infrared (ATR-IR) Spectrum
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| SpectraBase Spectrum ID | AxKz91zKKDh |
|---|---|
| Name | Primobolon Depot |
| Source of Sample | Cayman Chemical Company |
| Catalog Number | 17148 |
| Lot Number | 0639404-6 |
| Accessory | DurasamplIR II |
| CAS Registry Number | 303-42-4 |
| Copyright | Copyright © 2019-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 414.313395209 u |
| Formula | C27H42O3 |
| InChI | InChI=1S/C27H42O3/c1-5-6-7-8-9-25(29)30-24-13-12-22-21-11-10-19-17-20(28)16-18(2)27(19,4)23(21)14-15-26(22,24)3/h16,19,21-24H,5-15,17H2,1-4H3/t19-,21-,22-,23-,24-,26-,27-/m0/s1 |
| InChIKey | TXUICONDJPYNPY-FRXWOFFRSA-N |
| Instrument Name | Bio-Rad FTS |
| Molecular Weight | 414.630 g/mol |
| Purity | ≥98% |
| Resolution | 4 |
| SMILES | [C@]1(OC(=O)CCCCCC)([C@@]2([C@]([C@]3([C@@]([C@@]4([C@@](CC3)(CC(=O)C=C4C)[H])C)(CC2)[H])[H])(CC1)[H])C)[H] |
| Scan Speed (number) | 5 |
| Source of Spectrum | Forensic Spectral Research |
| Synonyms | (5α,17β)-1-methyl-17-[(1-oxoheptyl)oxy]-androst-1-en-3-one Methenolone Enanthate NSC 64967 SQ 16,374 |
| Technique | ATR-Neat |