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1,4-Methanoanthracene-5,8-dione-9-d, 1,2,3,4,8a,9,10,10a-octahydro-
SpectraBase Compound ID 6ZhvQzGapFZ
InChI InChI=1S/C15H16O2/c16-14-3-4-15(17)13-7-11-9-2-1-8(5-9)10(11)6-12(13)14/h3-4,8-9,12-13H,1-2,5-7H2/i6D
InChIKey DJOLFPKYQLMYJL-RAMDWTOOSA-N
Mol Weight 229.3 g/mol
Molecular Formula C15H152DO2
Exact Mass 229.121306 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID H2xt9wvD2Oo
Name 1,4-Methanoanthracene-5,8-dione-9-d, 1,2,3,4,8a,9,10,10a-octahydro-
Alternate Name(s) (9-d)-4a,5,6,7,8,9a,10-octahydro-5,8-methano-1,4-anthraquinone
CAS Registry Number 104824-85-3
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H15DO2
InChI InChI=1S/C15H16O2/c16-14-3-4-15(17)13-7-11-9-2-1-8(5-9)10(11)6-12(13)14/h3-4,8-9,12-13H,1-2,5-7H2/i6D
InChIKey DJOLFPKYQLMYJL-RAMDWTOOSA-N
Molecular Weight 229.297 g/mol
SMILES C12=C(C([2D])C3C(C2)C(C=CC3=O)=O)C2CC1CC2
SPLASH splash10-0fb9-0090000000-f7238080f2a6a1fbf834
Source of Spectrum H-68-1725-23
Wiley ID 1230207