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10-[(.alpha.,.alpha.-Dideuterio)benzylthio]-1,8-dihydroxy-9-anthrone
SpectraBase Compound ID F6vWcsubt1L
InChI InChI=1S/C21H16O3S/c22-16-10-4-8-14-18(16)20(24)19-15(9-5-11-17(19)23)21(14)25-12-13-6-2-1-3-7-13/h1-11,21-23H,12H2/i12D2
InChIKey SVCCMVDKTSCNNB-XUWBISKJSA-N
Mol Weight 350.43 g/mol
Molecular Formula C21H142D2O3S
Exact Mass 350.094569 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GWrYDMvhROp
Name 10-[(.alpha.,.alpha.-Dideuterio)benzylthio]-1,8-dihydroxy-9-anthrone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H14D2O3S
InChI InChI=1S/C21H16O3S/c22-16-10-4-8-14-18(16)20(24)19-15(9-5-11-17(19)23)21(14)25-12-13-6-2-1-3-7-13/h1-11,21-23H,12H2/i12D2
InChIKey SVCCMVDKTSCNNB-XUWBISKJSA-N
Molecular Weight 350.428 g/mol
SMILES Oc1cccc2c1C(c1c(cccc1C2SC(c1ccccc1)([2D])[2D])O)=O
SPLASH splash10-0fb9-1593000000-800582ebcc9ce4626ae3
Source of Spectrum D8-327-737-2
Wiley ID 1515413