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3-phenylalanine, octadecyl ester, hydrochloride
SpectraBase Compound ID 24WIHxSg5e1
InChI InChI=1S/C27H47NO2.ClH/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-20-23-30-27(29)26(28)24-25-21-18-17-19-22-25;/h17-19,21-22,26H,2-16,20,23-24,28H2,1H3;1H
InChIKey UJUGVJHDDQEBHF-UHFFFAOYSA-N
Mol Weight 454.14 g/mol
Molecular Formula C27H48ClNO2
Exact Mass 453.337357 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID Bjz5VHr8wbZ
Name 3-PHENYLALANINE, OCTADECYL ESTER, HYDROCHLORIDE
Source of Sample S. LANDI, CONNAUGHT RESEARCH INSTITUTE, WILLOWDALE, ONTARIO, CANADA
CAS Registry Number 95362-52-0
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H48ClNO2
InChI InChI=1S/C27H47NO2.ClH/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-20-23-30-27(29)26(28)24-25-21-18-17-19-22-25;/h17-19,21-22,26H,2-16,20,23-24,28H2,1H3;1H
InChIKey UJUGVJHDDQEBHF-UHFFFAOYSA-N
Literature Reference J. ORG. CHEM. 50, 1457(1985) Abstract-Chemical Abstracts= 102, 185457V(1985)
Melting Point 101-103C
Molecular Weight 454.135986
Synonyms ALANINE, 3-PHENYL-, OCTADECYL ESTER, HYDROCHLORIDE
Technique FILM (CAST FROM CHCl3)