| SpectraBase Spectrum ID |
8H4DvsB4Dse |
| Name |
Dobutamine |
| CAS Registry Number |
34368-04-2 |
| Classification |
Pharmaceutical drug, adrenergic |
| 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 |
301.167793602 u |
| Formula |
C18H23NO3 |
| InChI |
InChI=1S/C18H23NO3/c1-13(2-3-14-4-7-16(20)8-5-14)19-11-10-15-6-9-17(21)18(22)12-15/h4-9,12-13,19-22H,2-3,10-11H2,1H3 |
| InChIKey |
JRWZLRBJNMZMFE-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
301.386 g/mol |
| Nominal Mass |
301 u |
| Quality |
872 |
| SMILES |
OC1=C(C=C(C=C1)CCNC(CCC1=CC=C(C=C1)O)C)O |
| SPLASH |
splash10-0a6r-5900000000-302b367f21701bcefae5 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
4-[2-[4-(4-hydroxyphenyl)butan-2-ylamino]ethyl]benzene-1,2-diol |
| Technique |
DI/MS |
| Wiley ID |
DD2024_001230 |
