| SpectraBase Spectrum ID |
JEmcUMQVyF6 |
| Name |
Tolycaine |
| CAS Registry Number |
3686-58-6 |
| Classification |
Pharmaceutical drug, local anesthetic |
| Comments |
Spectrum verified by crosschecking against external libraries (one 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 |
278.163042573 u |
| Formula |
C15H22N2O3 |
| InChI |
InChI=1S/C15H22N2O3/c1-5-17(6-2)10-13(18)16-14-11(3)8-7-9-12(14)15(19)20-4/h7-9H,5-6,10H2,1-4H3,(H,16,18) |
| InChIKey |
UDKICLZCJWQTLS-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
278.352 g/mol |
| Nominal Mass |
278 u |
| Quality |
996 |
| Retention Index |
2169 |
| SMILES |
C=1(C(C(OC)=O)=CC=CC1C)NC(CN(CC)CC)=O |
| SPLASH |
splash10-000i-9100000000-4bbd6036583ec45e4b99 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
Methyl 2-[(2-diethylaminoacetyl)amino]-3-methyl benzoate |
| Technique |
GC/MS |
| Wiley ID |
DD2024_014085 |
