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Astemizole
SpectraBase Compound ID LjHTj3AZCzE
InChI InChI=1S/C28H31FN4O/c1-34-25-12-8-21(9-13-25)14-17-32-18-15-24(16-19-32)30-28-31-26-4-2-3-5-27(26)33(28)20-22-6-10-23(29)11-7-22/h2-13,24H,14-20H2,1H3,(H,30,31)
InChIKey GXDALQBWZGODGZ-UHFFFAOYSA-N
Mol Weight 458.58 g/mol
Molecular Formula C28H31FN4O
Exact Mass 458.24819 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID EYEyiUBFZAn
Name Astemizole
Source of Sample Biomol International, L.P.
Catalog Number NH-101
Lot Number 3-H2402a
CAS Registry Number 68844-77-9
Classification Anti-Allergic Agents; Antihistamines; Histamine H1 Antagonists, Non-Sedating
Compound Type Pure
Copyright Copyright © 2012-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H31FN4O
InChI InChI=1S/C28H31FN4O/c1-34-25-12-8-21(9-13-25)14-17-32-18-15-24(16-19-32)30-28-31-26-4-2-3-5-27(26)33(28)20-22-6-10-23(29)11-7-22/h2-13,24H,14-20H2,1H3,(H,30,31)
InChIKey GXDALQBWZGODGZ-UHFFFAOYSA-N
Raman Corrections Referenced to internal white light source; 180 Degree backscatter
Raman Laser Source Nd: YAG
Raman Laser Wavelength 1064
Sadtler IR Number DW0011
Source of Spectrum Forensic Spectral Research
Synonyms Hismanal; 1-((4-Fluorophenyl)methyl)-N-(1-(2-(4-methoxyphenyl)ethyl)-4-piperidinyl)-1H-benzimidazol-2-amine
Technique FT-Raman