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CHLORO[(4-HYDROXY-3-METHOXYPHENETHYL)AMINO]ZINC, p-TOLUENESULFONATE, HEMIHYDRATE

View entire compound with spectra: 1 FTIR

CHLORO[(4-HYDROXY-3-METHOXYPHENETHYL)AMINO]ZINC, p-TOLUENESULFONATE, HEMIHYDRATE
SpectraBase Compound ID 6QzFkYEHXi3
InChI InChI=1S/2C16H18NO4S.2ClH.H2O.2Zn/c2*1-12-3-6-14(7-4-12)22(18,19)21-15-8-5-13(9-10-17)11-16(15)20-2;;;;;/h2*3-8,11,17H,9-10H2,1-2H3;2*1H;1H2;;/q2*-1;;;;2*+2/p-2
InChIKey SOCGJSXMFCPIAJ-UHFFFAOYSA-L
Mol Weight 430.226 g/mol
Molecular Formula C16H18ClNO4SZn·½H2O
Exact Mass 427.998931 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID EYe8Xr4wDcl
Name CHLORO[(4-HYDROXY-3-METHOXYPHENETHYL)AMINO]ZINC, p-TOLUENESULFONATE, HEMIHYDRATE
Source of Sample T. Kametani, Tohoku University School of Medicine, Sendai, Japan
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C32H38Cl2N2O9S2Zn2
InChI InChI=1S/2C16H18NO4S.2ClH.H2O.2Zn/c2*1-12-3-6-14(7-4-12)22(18,19)21-15-8-5-13(9-10-17)11-16(15)20-2;;;;;/h2*3-8,11,17H,9-10H2,1-2H3;2*1H;1H2;;/q2*-1;;;;2*+2/p-2
InChIKey SOCGJSXMFCPIAJ-UHFFFAOYSA-L
Literature Reference Abstract-Chemical Abstracts= 60, 13222(1964)
Melting Point 172-173C
Molecular Weight 860.447720
Synonyms ZINC, CHLORO//4-HYDROXY-3-METHOXY- PHENETHYL/AMINO/-, P-TOLUENESULFONATE, HEMIHYDRATE PHENOL, 4-/2-AMINOETHYL/-2- METHOXY-, P-TOLUENESULFONATE /ESTER/, N-/CHLOROZINC/ DERIVATIVE, HEMIHYDRATE
Technique KBr WAFER