| SpectraBase Spectrum ID |
JpR6yOryoZc |
| Name |
Fexofenadine -H2O -CO2 |
| Classification |
Antihistamine |
| Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
439.287514814 u |
| Formula |
C31H37NO |
| InChI |
InChI=1S/C31H37NO/c1-25(2)27-18-16-26(17-19-27)11-9-10-22-32-23-20-30(21-24-32)31(33,28-12-5-3-6-13-28)29-14-7-4-8-15-29/h3-9,11-19,25,30,33H,10,20-24H2,1-2H3/b11-9+ |
| InChIKey |
IMQSZOUGQDPIIC-PKNBQFBNSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
439.643 g/mol |
| Related CAS Registry Number(s) |
83799-24-0 |
| SMILES |
C(C1CCN(CC\C=C\c2ccc(cc2)C(C)C)CC1)(c1ccccc1)(c1ccccc1)O |
| SPLASH |
splash10-001i-6490000000-f841f45f7ec042f9a933 |
| 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 |
| Technique |
GC/MS |
| Wiley ID |
MMPW6e_5223 |
