1-[alpha-(2,6-DINITRO-4-aci-NITRO-2,5-CYCLOHEXADIEN-1-YLIDENE)PHENACYL]ISOQUINOLINIUM HYDROXIDE, INNER SALT

SpectraBase Compound ID	6qLcE4aRjGx
InChI	InChI=1S/C23H14N4O7/c28-23(16-7-2-1-3-8-16)22(24-11-10-15-6-4-5-9-17(15)14-24)21-19(26(31)32)12-18(25(29)30)13-20(21)27(33)34/h1-14H
InChIKey	HXGSPKBLRXSNSF-UHFFFAOYSA-N Google Search
Mol Weight	458.39 g/mol
Molecular Formula	C23H14N4O7
Exact Mass	458.086249 g/mol

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SpectraBase Spectrum ID	HjT3REJmwqC
Name	1-[alpha-(2,6-DINITRO-4-aci-NITRO-2,5-CYCLOHEXADIEN-1-YLIDENE)PHENACYL]ISOQUINOLINIUM HYDROXIDE, INNER SALT
Source of Sample	F. Kroehnke, Justus Liebig-Universitat, Giessen, Germany
Copyright	Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C23H14N4O7
InChI	InChI=1S/C23H14N4O7/c28-23(16-7-2-1-3-8-16)22(24-11-10-15-6-4-5-9-17(15)14-24)21-19(26(31)32)12-18(25(29)30)13-20(21)27(33)34/h1-14H
InChIKey	HXGSPKBLRXSNSF-UHFFFAOYSA-N
Literature Reference	Abstract-Chemical Abstracts= 66, 18643(1967)
Melting Point	114-116C (dec.)
Molecular Weight	458.386760
Synonyms	ISOQUINOLINIUM HYDROXIDE, 2-/A- /2,6-DINITRO-4-ACI-NITRO-2,5-CYCLOHEXA- DIEN-1-YLIDENE/PHENACYL/-, INNER SALT
Technique	KBr WAFER