| SpectraBase Spectrum ID |
D1Xs4gg1lAq |
| Name |
Tritoqualine artifact-1 |
| Classification |
Antihistamine |
| Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
281.126322711 u |
| Formula |
C14H19NO5 |
| InChI |
InChI=1S/C14H19NO5/c1-4-17-11-8-7-20-14(16)9(8)10(15)12(18-5-2)13(11)19-6-3/h4-7,15H2,1-3H3 |
| InChIKey |
IXXXFEBGBAMSCK-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
281.308 g/mol |
| Related CAS Registry Number(s) |
14504-73-5 |
| SMILES |
c12c(c(OCC)c(c(c2N)OCC)OCC)COC1=O |
| SPLASH |
splash10-0fza-2590000000-e75969a2bf866cb6cb7e |
| 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. |
| 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_5236 |
