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N,N'-Dimethylmalonyl-2-thia-10,11-diaza[3,2]metacyclophane
SpectraBase Compound ID 27NrF6Gid1Z
InChI InChI=1S/C19H18N2O2S/c1-19(2)17(22)20-15-7-3-5-13(9-15)11-24-12-14-6-4-8-16(10-14)21(20)18(19)23/h3-10H,11-12H2,1-2H3
InChIKey JQVLNQDPTVEQHE-UHFFFAOYSA-N
Mol Weight 338.43 g/mol
Molecular Formula C19H18N2O2S
Exact Mass 338.108899 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4oReJekunKy
Name N,N'-DIMETHYLMALONYL-2-THIA-10,11-DIAZA[3,2]METACYCLOPHANE
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C19H18N2SO2
InChI InChI=1S/C19H18N2O2S/c1-19(2)17(22)20-15-7-3-5-13(9-15)11-24-12-14-6-4-8-16(10-14)21(20)18(19)23/h3-10H,11-12H2,1-2H3
InChIKey JQVLNQDPTVEQHE-UHFFFAOYSA-N
Molecular Weight 338.1085
SMILES c12N3C(C(C(N3c3cccc(CSCc(c2)ccc1)c3)=O)(C)C)=O
SPLASH splash10-000i-5945000000-6566745ad486b01fabdb
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany