| SpectraBase Compound ID | HJXFqVkKINm |
|---|---|
| InChI | InChI=1S/C22H31N3O2/c1-15(2)21(22(23)27)24-20(26)12-17-14-25(13-16-8-4-3-5-9-16)19-11-7-6-10-18(17)19/h6-7,10-11,14-16,21H,3-5,8-9,12-13H2,1-2H3,(H2,23,27)(H,24,26)/t21-/m0/s1 |
| InChIKey | KMEBOUOZCGQKFG-NRFANRHFSA-N |
| Mol Weight | 369.51 g/mol |
| Molecular Formula | C22H31N3O2 |
| Exact Mass | 369.241627 g/mol |
Attenuated Total Reflectance Infrared (ATR-IR) Spectrum
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| SpectraBase Spectrum ID | G5SDSbsp4YW |
|---|---|
| Name | AB-CHMIATA |
| Source of Sample | Cayman Chemical Company |
| Catalog Number | 38136 |
| Lot Number | 0673287-3 |
| Accessory | DurasamplIR II |
| Copyright | Copyright © 2019-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 369.241627248 u |
| Formula | C22H31N3O2 |
| InChI | InChI=1S/C22H31N3O2/c1-15(2)21(22(23)27)24-20(26)12-17-14-25(13-16-8-4-3-5-9-16)19-11-7-6-10-18(17)19/h6-7,10-11,14-16,21H,3-5,8-9,12-13H2,1-2H3,(H2,23,27)(H,24,26)/t21-/m0/s1 |
| InChIKey | KMEBOUOZCGQKFG-NRFANRHFSA-N |
| Instrument Name | Bio-Rad FTS |
| Molecular Weight | 369.509 g/mol |
| Purity | ≥98% |
| Resolution | 4 |
| SMILES | CC([C@@]([H])(C(N)=O)NC(CC1=CN(CC2CCCCC2)C2=CC=CC=C12)=O)C |
| Scan Speed (number) | 5 |
| Source of Spectrum | Forensic Spectral Research |
| Synonyms | (S)-2-(2-(1-(cyclohexylmethyl)-1H-indol-3-yl)acetamido)-3-methylbutanamide |
| Technique | ATR-Neat |