| SpectraBase Compound ID | EGVROKN8jCh |
|---|---|
| InChI | InChI=1S/C29H41NO4.ClH/c1-25(2,3)26(4,32)20-15-27-10-11-29(20,33-5)24-28(27)12-13-30(16-17-6-7-17)21(27)14-18-8-9-19(31)23(34-24)22(18)28;/h8-9,17,20-21,24,31-32H,6-7,10-16H2,1-5H3;1H/t20-,21-,24-,26+,27-,28+,29-;/m1./s1 |
| InChIKey | UAIXRPCCYXNJMQ-RZIPZOSSSA-N |
| Mol Weight | 504.1 g/mol |
| Molecular Formula | C29H42ClNO4 |
| Exact Mass | 503.280237 g/mol |
Transmission Infrared (IR) Spectrum
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| SpectraBase Spectrum ID | B5SWAAEE7WQ |
|---|---|
| Name | Buprenophine hydrochloride |
| Source of Sample | Alltech Associates, Inc., Grace Davison Discovery Sciences |
| Catalog Number | 01651 |
| Lot Number | 498 |
| Apodization Function | Triangular |
| CAS Registry Number | 53152-21-9 |
| Copyright | Copyright © 2012-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| DEA Schedule | III |
| Formula | C29H42ClNO4 |
| InChI | InChI=1S/C29H41NO4.ClH/c1-25(2,3)26(4,32)20-15-27-10-11-29(20,33-5)24-28(27)12-13-30(16-17-6-7-17)21(27)14-18-8-9-19(31)23(34-24)22(18)28;/h8-9,17,20-21,24,31-32H,6-7,10-16H2,1-5H3;1H/t20-,21-,24-,26+,27-,28+,29-;/m1./s1 |
| InChIKey | UAIXRPCCYXNJMQ-RZIPZOSSSA-N |
| Instrument Name | Bio-Rad FTS |
| Molecular Weight | 504.111 g/mol |
| SMILES | Cl.Oc1c2c3[C@@]45[C@]([C@@]6([C@@]([C@@](C)(C(C)(C)C)O)(C[C@@]4([C@@](Cc3cc1)(N(CC5)CC1CC1)[H])CC6)[H])OC)(O2)[H] |
| Scan Speed (number) | 5 |
| Source of Spectrum | Forensic Spectral Research |
| Synonyms | Buprenophine HCl |
| Technique | KBr0 |