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

SpectraBase Compound ID	HJWZ7nhZidx
InChI	InChI=1S/C16H18NO4S.ClH.H2O.Zn/c1-12-3-6-14(7-4-12)22(18,19)21-15-8-5-13(9-10-17)11-16(15)20-2;;;/h3-8,11,17H,9-10H2,1-2H3;1H;1H2;/q-1;;;+2/p-1
InChIKey	POCYIMWHDDQAQK-UHFFFAOYSA-M Google Search
Mol Weight	430.226 g/mol
Molecular Formula	C16H18ClNO4SZn·½H2O
Exact Mass	427.998931 g/mol

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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, 1981-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C32H38Cl2N2O9S2Zn2
InChI	InChI=1S/C16H18NO4S.ClH.H2O.Zn/c1-12-3-6-14(7-4-12)22(18,19)21-15-8-5-13(9-10-17)11-16(15)20-2;;;/h3-8,11,17H,9-10H2,1-2H3;1H;1H2;/q-1;;;+2/p-1
InChIKey	POCYIMWHDDQAQK-UHFFFAOYSA-M
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