| SpectraBase Compound ID | HHrtt7AzwFS |
|---|---|
| InChI | InChI=1S/C20H29N3O3/c1-6-7-10-13-23-15-12-9-8-11-14(15)16(22-23)18(24)21-17(19(25)26-5)20(2,3)4/h8-9,11-12,17H,6-7,10,13H2,1-5H3,(H,21,24)/t17-/m1/s1 |
| InChIKey | QSNCKXRHFRDPRX-QGZVFWFLSA-N |
| Mol Weight | 359.47 g/mol |
| Molecular Formula | C20H29N3O3 |
| Exact Mass | 359.220892 g/mol |
Attenuated Total Reflectance Infrared (ATR-IR) Spectrum
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| SpectraBase Spectrum ID | 7ig6UoPwCcK |
|---|---|
| Name | MDMB-PINACA |
| Source of Sample | Cayman Chemical Company |
| Catalog Number | 39730 |
| Lot Number | 0689485-2 |
| Accessory | DurasamplIR II |
| CAS Registry Number | 1971007-99-4 |
| Copyright | Copyright © 2019-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 359.220891803 u |
| Formula | C20H29N3O3 |
| InChI | InChI=1S/C20H29N3O3/c1-6-7-10-13-23-15-12-9-8-11-14(15)16(22-23)18(24)21-17(19(25)26-5)20(2,3)4/h8-9,11-12,17H,6-7,10,13H2,1-5H3,(H,21,24)/t17-/m1/s1 |
| InChIKey | QSNCKXRHFRDPRX-QGZVFWFLSA-N |
| Instrument Name | Bio-Rad FTS |
| Molecular Weight | 359.470 g/mol |
| Purity | ≥98% |
| Resolution | 4 |
| SMILES | C([C@@](NC(=O)C1=NN(C=2C=CC=CC12)CCCCC)(C(C)(C)C)[H])(=O)OC |
| Scan Speed (number) | 5 |
| Source of Spectrum | Forensic Spectral Research |
| Synonyms | 3-methyl-N-[(1-pentyl-1H-indazol-3-yl)carbonyl]-L-valine methyl ester |
| Technique | ATR-Film |