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2-chloro-9-(1-methyl-4-piperidylidene)xanthene, methanesulfonate(1:1)

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2-chloro-9-(1-methyl-4-piperidylidene)xanthene, methanesulfonate(1:1)
SpectraBase Compound ID GpjLBLStD8W
InChI InChI=1S/C19H18ClNO.CH4O3S/c1-21-10-8-13(9-11-21)19-15-4-2-3-5-17(15)22-18-7-6-14(20)12-16(18)19;1-5(2,3)4/h2-7,12H,8-11H2,1H3;1H3,(H,2,3,4)
InChIKey CPNAKTVMAXLKKO-UHFFFAOYSA-N
Mol Weight 407.91 g/mol
Molecular Formula C20H22ClNO4S
Exact Mass 407.095807 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 8O3ZixoyYj4
Name 2-CHLORO-9-(1-METHYL-4-PIPERIDYLIDENE)XANTHENE, METHANESULFONATE (1:1)
Source of Sample M. A. Christie, Smithkline Chemicals, Conshohocken, Pennsylvania
Comments Some carbon atoms are unassigned
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H18ClNO CH4O3S
InChI InChI=1S/C19H18ClNO.CH4O3S/c1-21-10-8-13(9-11-21)19-15-4-2-3-5-17(15)22-18-7-6-14(20)12-16(18)19;1-5(2,3)4/h2-7,12H,8-11H2,1H3;1H3,(H,2,3,4)
InChIKey CPNAKTVMAXLKKO-UHFFFAOYSA-N
Melting Point 225-226C
Molecular Weight 407.92
Solvent Chloroform-d; Reference=TMS Spectrometer= Varian CFT-20