| SpectraBase Spectrum ID |
KCPHMGZmPXX |
| Name |
Phenyltoloxamine-M isomer-1 AC |
| Classification |
Antihistamine |
| Comments |
Structure comment: Wiggly bond = unknown position of substituent |
| Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
313.167793602 u |
| Formula |
C19H23NO3 |
| InChI |
InChI=1S/C19H23NO3/c1-3-20-11-12-22-19-14-18(23-15(2)21)10-9-17(19)13-16-7-5-4-6-8-16/h4-10,14,20H,3,11-13H2,1-2H3 |
| InChIKey |
ZLNKRHBFWMTAIS-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
313.397 g/mol |
| SMILES |
c1(c(OCCNCC)cc(cc1)OC(C)=O)Cc1ccccc1 |
| SPLASH |
splash10-0a4i-9100000000-3e0ee8204e79acb43aa2 |
| 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: U+UHYAC |
| Source of Spectrum |
H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany |
| Synonyms |
Phenyltoloxamine-M (HO-) isomer-1 AC |
| Technique |
GC/MS |
| Wiley ID |
MMPW6e_1686 |
