SpectraBase Spectrum ID |
8KAvGgeco6q |
Name |
Adrenalone |
CAS Registry Number |
99-45-6 |
Classification |
Pharmaceutical drug, vasoconstrictor |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
181.073893215 u |
Formula |
C9H11NO3 |
InChI |
InChI=1S/C9H11NO3/c1-10-5-9(13)6-2-3-7(11)8(12)4-6/h2-4,10-12H,5H2,1H3 |
InChIKey |
PZMVOUYYNKPMSI-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
181.191 g/mol |
Nominal Mass |
181 u |
Quality |
838 |
SMILES |
OC=1C=CC(=CC1O)C(CNC)=O |
SPLASH |
splash10-0udi-4900000000-b8a4cc32935631ffa657 |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
Adrenalon
1-(3,4-dihydroxyphenyl)-2-methylamino-ethanone |
Technique |
DI/MS |
Wiley ID |
DD2024_000056 |