SpectraBase Spectrum ID |
uc6pQHNQW |
Name |
Buclizine |
CAS Registry Number |
82-95-1 |
Classification |
Antihistamine |
Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
432.233226771 u |
Formula |
C28H33ClN2 |
InChI |
InChI=1S/C28H33ClN2/c1-28(2,3)25-13-9-22(10-14-25)21-30-17-19-31(20-18-30)27(23-7-5-4-6-8-23)24-11-15-26(29)16-12-24/h4-16,27H,17-21H2,1-3H3 |
InChIKey |
MOYGZHXDRJNJEP-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
433.039 g/mol |
SMILES |
c1(C(c2ccccc2)N2CCN(Cc3ccc(C(C)(C)C)cc3)CC2)ccc(cc1)Cl |
SPLASH |
splash10-00lr-0890000000-fd2c1cedb1a61357b266 |
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: G U UHY 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_2414 |