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(1aS,9bR)-1-(benzenesulfinyl)-1a,9b-dihydro-1H-cyclopropa[l]phenanthrene
SpectraBase Compound ID BhUqEyKajG9
InChI InChI=1S/C21H16OS/c22-23(14-8-2-1-3-9-14)21-19-17-12-6-4-10-15(17)16-11-5-7-13-18(16)20(19)21/h1-13,19-21H/t19-,20+,21?,23?
InChIKey DXZWSTNZQFMKMH-CVFDLSLPSA-N
Mol Weight 316.42 g/mol
Molecular Formula C21H16OS
Exact Mass 316.092186 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CwJPeoYIWlM
Name (1aS,9bR)-1-(benzenesulfinyl)-1a,9b-dihydro-1H-cyclopropa[l]phenanthrene
Alternate Name(s) (1aS,9bR)-1-(phenylsulfinyl)-1a,9b-dihydro-1H-cyclopropa[l]phenanthrene
CAS Registry Number 106032-11-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H16OS
InChI InChI=1S/C21H16OS/c22-23(14-8-2-1-3-9-14)21-19-17-12-6-4-10-15(17)16-11-5-7-13-18(16)20(19)21/h1-13,19-21H/t19-,20+,21?,23?
InChIKey DXZWSTNZQFMKMH-CVFDLSLPSA-N
Molecular Weight 316.418 g/mol
SMILES [C@@]12([C@](c3ccccc3-c3c2cccc3)([H])C1S(=O)c1ccccc1)[H]
SPLASH splash10-0006-0920000000-11ac3eb6468c08f183cf
Source of Spectrum H-69-863-6
Wiley ID 1317135