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Buclizine
SpectraBase Compound ID 2z79mwqpO9s
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
Mol Weight 433.0 g/mol
Molecular Formula C28H33ClN2
Exact Mass 432.233227 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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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