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[O-CD3,17,17-D2]prosolanapyrone
SpectraBase Compound ID FtJ589lsEbY
InChI InChI=1S/C18H24O3/c1-4-5-6-7-8-9-10-11-12-13-16-14-17(20-3)15(2)18(19)21-16/h4-7,12-14H,8-11H2,1-3H3/b5-4+,7-6+,13-12+/i2D2,3D3
InChIKey HABKBTVBKICYGZ-CXOIKBHMSA-N
Mol Weight 293.42 g/mol
Molecular Formula C18H19D5O3
Exact Mass 293.203928 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5M2qqtrCirS
Name [O-CD3,17,17-D2]prosolanapyrone
Alternate Name(s) [O-C2H3,17,17-2H2]prosolanapyrone
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Formula C18H19D5O3
InChI InChI=1S/C18H24O3/c1-4-5-6-7-8-9-10-11-12-13-16-14-17(20-3)15(2)18(19)21-16/h4-7,12-14H,8-11H2,1-3H3/b5-4+,7-6+,13-12+/i2D2,3D3
InChIKey HABKBTVBKICYGZ-CXOIKBHMSA-N
Molecular Weight 293.418 g/mol
SMILES C=1(C(OC(=CC1OC([D])([D])[D])\C=C\CCCC\C=C\C=C\C)=O)C([D])[D]
SPLASH splash10-059f-7920000000-0085d1c3fc3e9873bd3d
Source of Spectrum KC-0-1231-6
Wiley ID 827807