SpectraBase Spectrum ID |
JSmfIt3tm2A |
Name |
Roxatidine HY formyl artifact |
Classification |
H2-Blocker |
Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
260.188863400 u |
Formula |
C16H24N2O |
InChI |
InChI=1S/C16H24N2O/c1-17-9-6-12-19-16-8-5-7-15(13-16)14-18-10-3-2-4-11-18/h5,7-8,13H,1-4,6,9-12,14H2 |
InChIKey |
JUKKLBBCCPETKJ-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
260.381 g/mol |
SMILES |
C1CCN(Cc2cc(OCCCN=C)ccc2)CC1 |
SPLASH |
splash10-001i-9410000000-8ea96f2b1397feb5ddfb |
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_4202 |