| SpectraBase Spectrum ID |
8IKnmb1EleK |
| Name |
Bupivacaine |
| CAS Registry Number |
2180-92-9 |
| Classification |
Pharmaceutical drug, local anesthetic |
| Comments |
Spectrum verified by crosschecking against external libraries (seven reference spectrum with similarity >= 99% found); Spectrum verified by independent measurements in external laboratories |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
288.220163529 u |
| Formula |
C18H28N2O |
| InChI |
InChI=1S/C18H28N2O/c1-4-5-12-20-13-7-6-11-16(20)18(21)19-17-14(2)9-8-10-15(17)3/h8-10,16H,4-7,11-13H2,1-3H3,(H,19,21) |
| InChIKey |
LEBVLXFERQHONN-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
288.435 g/mol |
| Nominal Mass |
288 u |
| Quality |
996 |
| Retention Index |
2300 |
| SMILES |
C=1(NC(C2N(CCCC2)CCCC)=O)C(=CC=CC1C)C |
| SPLASH |
splash10-0006-3900000000-3d43682e37ff8ef354db |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
Bupivacain
Bupivacaina
1-Butyl-N-(2,6-dimethylphenyl)piperidine-2-carboxamide |
| Technique |
GC/MS |
| Wiley ID |
DD2024_000367 |
