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(8-Ethoxy-4,4-dimethyl-4,5-dihydro-1H-[1,2]dithiolo[3,4-c]quinolin-1-ylidene)[4-(4-chlorobenzyl)oxyphenyl]amine
SpectraBase Compound ID 8JnTMWVTMYX
InChI InChI=1S/C27H25ClN2O2S2/c1-4-31-21-13-14-23-22(15-21)24-25(27(2,3)30-23)33-34-26(24)29-19-9-11-20(12-10-19)32-16-17-5-7-18(28)8-6-17/h5-15,30H,4,16H2,1-3H3
InChIKey WQMYOPIUDHLKGZ-UHFFFAOYSA-N
Mol Weight 509.08 g/mol
Molecular Formula C27H25ClN2O2S2
Exact Mass 508.104598 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GFRl2QtMds2
Name (8-Ethoxy-4,4-dimethyl-4,5-dihydro-1H-[1,2]dithiolo[3,4-c]quinolin-1-ylidene)[4-(4-chlorobenzyl)oxyphenyl]amine
Appearance Yellow crystals
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H25ClN2O2S2
InChI InChI=1S/C27H25ClN2O2S2/c1-4-31-21-13-14-23-22(15-21)24-25(27(2,3)30-23)33-34-26(24)29-19-9-11-20(12-10-19)32-16-17-5-7-18(28)8-6-17/h5-15,30H,4,16H2,1-3H3
InChIKey WQMYOPIUDHLKGZ-UHFFFAOYSA-N
Instrument Name Finnigan MAT Incos 50
Ionization Type EI
Literature Reference DOI 10.24820/ark.5550190.p010.140
Molecular Weight 509.082 g/mol
SMILES N1C(C=2SSC(C2c2cc(ccc12)OCC)=Nc1ccc(cc1)OCc1ccc(cc1)Cl)(C)C
SPLASH splash10-05mo-0169660000-487e9f8f18c49c8edac0
Source of Spectrum ARK-2017-275-3e
Wiley ID 1840858