spiro[1H-benz[de]isoquinoline-2(3H),1'-piperidium] p-toluenesulfonate

SpectraBase Compound ID	5IS1SwmdHds
InChI	InChI=1S/C17H20N.C7H8O3S/c1-2-10-18(11-3-1)12-15-8-4-6-14-7-5-9-16(13-18)17(14)15;1-6-2-4-7(5-3-6)11(8,9)10/h4-9H,1-3,10-13H2;2-5H,1H3,(H,8,9,10)/q+1;/p-1
InChIKey	KTZODGBNTRRTMR-UHFFFAOYSA-M Google Search
Mol Weight	409.54 g/mol
Molecular Formula	C24H27NO3S
Exact Mass	409.171165 g/mol

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SpectraBase Spectrum ID	LirtviuphZc
Name	SPIRO[1H-BENZ[d,e]ISOQUINOLINE-2(3H),1'-PIPERIDINIUM] p-TOLUENESULFONATE
Source of Sample	N. B. Mehta, Burroughs Wellcome & Company, Inc., Tuckahoe, New York
Copyright	Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C24H27NO3S
InChI	InChI=1S/C17H20N.C7H8O3S/c1-2-10-18(11-3-1)12-15-8-4-6-14-7-5-9-16(13-18)17(14)15;1-6-2-4-7(5-3-6)11(8,9)10/h4-9H,1-3,10-13H2;2-5H,1H3,(H,8,9,10)/q+1;/p-1
InChIKey	KTZODGBNTRRTMR-UHFFFAOYSA-M
Literature Reference	JOCE 28, 2843(1963)
Melting Point	196-197C
Molecular Weight	409.544006
Synonyms	SPIRO/1H-BENZ/D,E/ISOQUINOLINE- 2/3H/,1PR-PIPERIDINIUM/ P-TOLUENE- SULFONATE
Technique	KBr WAFER