| SpectraBase Spectrum ID |
6r9RB9Yfv9V |
| Name |
Roxatidine HY PFP |
| Classification |
H2-Blocker |
| Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
394.167968802 u |
| Formula |
C18H23F5N2O2 |
| InChI |
InChI=1S/C18H23F5N2O2/c19-17(20,18(21,22)23)16(26)24-8-5-11-27-15-7-4-6-14(12-15)13-25-9-2-1-3-10-25/h4,6-7,12H,1-3,5,8-11,13H2,(H,24,26) |
| InChIKey |
VVEQKLFTNCDRFM-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
394.386 g/mol |
| SMILES |
C(C(F)(F)F)(C(=O)NCCCOc1cc(CN2CCCCC2)ccc1)(F)F |
| SPLASH |
splash10-0kai-9321000000-19b999c51ff28cbda3bc |
| 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_4204 |
