SpectraBase Spectrum ID |
LIRSlsTxXEM |
Name |
Clotrimazole |
CAS Registry Number |
23593-75-1 |
Collision Energy |
35 eV |
Copyright |
Copyright © 2012-2025 Herbert Oberacher. All Rights Reserved. |
Exact Mass |
344.108026255 u |
Formula |
C22H17ClN2 |
InChI |
InChI=1S/C22H17ClN2/c23-21-14-8-7-13-20(21)22(25-16-15-24-17-25,18-9-3-1-4-10-18)19-11-5-2-6-12-19/h1-17H |
InChIKey |
VNFPBHJOKIVQEB-UHFFFAOYSA-N |
Instrument Name |
QStar XL, AB Sciex |
Ion Polarity |
P |
Ionization Type |
ESI+ |
Molecular Weight |
344.845 g/mol |
Nominal Mass |
344 u |
Precursor Ion |
[M+H]+ |
Precursor m/z |
345.115 |
SMILES |
C=1(Cl)C(C(N2C=CN=C2)(C2=CC=CC=C2)C2=CC=CC=C2)=CC=CC1 |
Selected Ion Charge |
1 |
Source of Spectrum |
Herbert Oberacher, Institute of Legal Medicine, Innsbruck/Austria |
Spectrum Type |
ms2 |
Synonyms |
1-[(2-chlorophenyl)-diphenylmethyl]imidazole |
Technique |
Q-TOF |
Wiley ID |
MSforID_+_236.6 |