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Cuspareine
SpectraBase Compound ID 5XWPrW9K2lH
InChI InChI=1S/C20H25NO2/c1-21-17(12-10-16-6-4-5-7-18(16)21)11-8-15-9-13-19(22-2)20(14-15)23-3/h4-7,9,13-14,17H,8,10-12H2,1-3H3
InChIKey MBIROIXKTFTFJX-UHFFFAOYSA-N
Mol Weight 311.43 g/mol
Molecular Formula C20H25NO2
Exact Mass 311.188529 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IUpnxrzJoc4
Name Cuspareine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H25NO2
InChI InChI=1S/C20H25NO2/c1-21-17(12-10-16-6-4-5-7-18(16)21)11-8-15-9-13-19(22-2)20(14-15)23-3/h4-7,9,13-14,17H,8,10-12H2,1-3H3
InChIKey MBIROIXKTFTFJX-UHFFFAOYSA-N
Literature Reference DOI 10.1002/pca.594
Molecular Weight 311.425 g/mol
SMILES c1ccc2c(CCC(CCc3ccc(c(c3)OC)OC)N2C)c1
SPLASH splash10-0002-0901000000-0ddb482e75851838fc42
Source of Spectrum PA-12-317-13
Synonyms 2-(3,4-dimethoxyphenethyl)-1-methyl-1,2,3,4-tetrahydroquinoline
Wiley ID 1789429