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1,3-Dioxane-4,6-dione, 5-[(3,4-dihydro-1-methyl-2(1H)-isoquinolinyl)methylene]-2,2-dimethyl-, (S)-
SpectraBase Compound ID 3LzLIPEpAVi
InChI InChI=1S/C17H19NO4/c1-11-13-7-5-4-6-12(13)8-9-18(11)10-14-15(19)21-17(2,3)22-16(14)20/h4-7,10-11H,8-9H2,1-3H3/t11-/m0/s1
InChIKey DXTCKKSGZMZJHB-NSHDSACASA-N
Mol Weight 301.34 g/mol
Molecular Formula C17H19NO4
Exact Mass 301.131408 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HquoJ9UGbXS
Name 1,3-Dioxane-4,6-dione, 5-[(3,4-dihydro-1-methyl-2(1H)-isoquinolinyl)methylene]-2,2-dimethyl-, (S)-
Alternate Name(s) 2,2-Dimethyl-5-[((1S)-1-methyl-3,4-dihydro-2(1H)-isoquinolinyl)methylene]-1,3-dioxane-4,6-dione 5-(2-(1-methyl)tetrahydroisoquinolyl-methylene)-2,2-dimethyl-1,3-dioxane-4,6-dione
CAS Registry Number 110396-68-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H19NO4
InChI InChI=1S/C17H19NO4/c1-11-13-7-5-4-6-12(13)8-9-18(11)10-14-15(19)21-17(2,3)22-16(14)20/h4-7,10-11H,8-9H2,1-3H3/t11-/m0/s1
InChIKey DXTCKKSGZMZJHB-NSHDSACASA-N
Molecular Weight 301.342 g/mol
SMILES C1(C(OC(OC1=O)(C)C)=O)=CN1[C@](c2ccccc2CC1)(C)[H]
SPLASH splash10-00b9-0940000000-3f83e2afc507f91aaa4a
Source of Spectrum KC-1988-872-6
Wiley ID 1303878