| SpectraBase Spectrum ID |
DnFwruF6u8m |
| Name |
Procaine-A 2ME |
| CAS Registry Number |
18358-63-9 |
| Classification |
Pharmaceutical drug, local anesthetic |
| Comments |
Spectrum verified by crosschecking against external libraries (one reference spectrum with similarity >= 99% found) |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
165.078978596 u |
| Formula |
C9H11NO2 |
| InChI |
InChI=1S/C9H11NO2/c1-10-8-5-3-7(4-6-8)9(11)12-2/h3-6,10H,1-2H3 |
| InChIKey |
LLAMGYUWYUMHCH-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
165.192 g/mol |
| Nominal Mass |
165 u |
| Quality |
981 |
| Retention Index |
1566 |
| SMILES |
C1(C(OC)=O)=CC=C(C=C1)NC |
| SPLASH |
splash10-00lr-6900000000-403c586ec642bf219af0 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
Methyl 4(methylamino)benzoate
methyl 4-(methylamino)benzoate |
| Technique |
GC/MS |
| Wiley ID |
DD2024_005723 |
