SpectraBase Spectrum ID |
ItFzXLx36ZG |
Name |
Ketotifen |
CAS Registry Number |
34580-13-7 |
Classification |
Antihistamine |
Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
309.118735409 u |
Formula |
C19H19NOS |
InChI |
InChI=1S/C19H19NOS/c1-20-9-6-13(7-10-20)18-15-5-3-2-4-14(15)12-17(21)19-16(18)8-11-22-19/h2-5,8,11H,6-7,9-10,12H2,1H3 |
InChIKey |
ZCVMWBYGMWKGHF-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
309.427 g/mol |
SMILES |
c12c(C(c3ccccc3CC2=O)=C2CCN(CC2)C)ccs1 |
SPLASH |
splash10-0a4i-4398000000-d34aafad210f6b6db063 |
Sample Comments |
The MMPW Reference Handbook and associated Tables are attached to Record #1, under the Attachments tab. Refer to these references for an explanation of the Sample Preparation Procedure "Detected" abbreviations, as well as other relevant information pertaining to this database. |
Sample Preparation Procedure |
Detected: G U+UHYAC |
Source of Spectrum |
H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany |
Technique |
GC/MS |
Wiley ID |
MMPW6e_1472 |