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1,4-Epoxy-4a,12b-methanotriphenylene, 1,4-dihydro-, (1.alpha.,4.alpha.,4a.alpha.,12b.alpha.)-
SpectraBase Compound ID 3luFz8OXW4T
InChI InChI=1S/C19H14O/c1-3-7-14-12(5-1)13-6-2-4-8-15(13)19-11-18(14,19)16-9-10-17(19)20-16/h1-10,16-17H,11H2/t16-,17+,18+,19-
InChIKey FIIMQAKDVNKZEB-SEXKYXSUSA-N
Mol Weight 258.32 g/mol
Molecular Formula C19H14O
Exact Mass 258.104465 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6LcldW6F8wX
Name 1,4-Epoxy-4a,12b-methanotriphenylene, 1,4-dihydro-, (1.alpha.,4.alpha.,4a.alpha.,12b.alpha.)-
CAS Registry Number 98420-59-8
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H14O
InChI InChI=1S/C19H14O/c1-3-7-14-12(5-1)13-6-2-4-8-15(13)19-11-18(14,19)16-9-10-17(19)20-16/h1-10,16-17H,11H2/t16-,17+,18+,19-
InChIKey FIIMQAKDVNKZEB-SEXKYXSUSA-N
Molecular Weight 258.320 g/mol
SMILES [C@]123[C@@](c4ccccc4-c4c3cccc4)([C@]3([H])O[C@]2(C=C3)[H])C1
SPLASH splash10-004i-0090000000-68f3478065d0f1ab0042
Source of Spectrum B-40-935-16
Synonyms (1.alpha.,4.alpha.,4a.alpha.,12b.alpha.)-1,4-Dihydro-1,4-epoxy-4a,12b-methanotriphenylene (1R,14S,15S,18R)-20-oxahexacyclo[12.4.1.1(15,18).0(1,14).0(2,7).0(8,13)]icosa-2,4,6,8,10,12,16-heptaene
Wiley ID 1262348