SpectraBase Spectrum ID |
Djr9jWjbHQ8 |
Name |
Isoxsuprine |
CAS Registry Number |
395-28-8 |
Classification |
Pharmaceutical drug, sympathomimetic, vasodilator |
Comments |
Spectrum verified by independent measurements in external laboratories |
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(12-22-17-6-4-3-5-7-17)19-14(2)18(21)15-8-10-16(20)11-9-15/h3-11,13-14,18-21H,12H2,1-2H3 |
InChIKey |
BMUKKTUHUDJSNZ-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
301.386 g/mol |
Nominal Mass |
301 u |
Quality |
1000 |
Retention Index |
2300 |
SMILES |
OC=1C=CC(C(C(NC(COC2=CC=CC=C2)C)C)O)=CC1 |
SPLASH |
splash10-004i-5900000000-1a72689fcf00cb8d5129 |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
Isoksuprin
Isosuprin
4-[1-Hydroxy-2-(1-phenoxypropan-2-ylamino)propyl]phenol |
Technique |
GC/MS |
Wiley ID |
DD2024_007444 |