| SpectraBase Spectrum ID |
77iXMqAHrBP |
| Name |
Indoprofen |
| CAS Registry Number |
31842-01-0 |
| Collision Energy |
20 eV |
| Copyright |
Copyright © 2012-2025 Herbert Oberacher. All Rights Reserved. |
| Exact Mass |
281.105193344 u |
| Formula |
C17H15NO3 |
| InChI |
InChI=1S/C17H15NO3/c1-11(17(20)21)12-6-8-14(9-7-12)18-10-13-4-2-3-5-15(13)16(18)19/h2-9,11H,10H2,1H3,(H,20,21) |
| InChIKey |
RJMIEHBSYVWVIN-UHFFFAOYSA-N |
| Instrument Name |
QStar XL, AB Sciex |
| Ion Polarity |
N |
| Ionization Type |
ESI- |
| Molecular Weight |
281.311 g/mol |
| Nominal Mass |
281 u |
| Precursor Ion |
[M-H]- |
| Precursor m/z |
280.098 |
| SMILES |
OC(=O)C(C1=CC=C(N2CC=3C(C2=O)=CC=CC3)C=C1)C |
| Selected Ion Charge |
-1 |
| Source of Spectrum |
Herbert Oberacher, Institute of Legal Medicine, Innsbruck/Austria |
| Spectrum Type |
ms2 |
| Synonyms |
2-[4-(3-oxo-1H-isoindol-2-yl)phenyl]propanoic acid |
| Technique |
Q-TOF |
| Wiley ID |
MSforID_-_79.3 |
