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8,13-Epoxy-7a,813,13a-tetrahydro-14H-dibnezo[a,I]thioxanthene
SpectraBase Compound ID Lg7unAYGSCR
InChI InChI=1S/C21H16OS/c1-2-6-13-12(5-1)9-10-18-16(13)11-17-19-14-7-3-4-8-15(14)20(22-19)21(17)23-18/h1-10,17,19-21H,11H2/t17-,19-,20+,21-/m0/s1
InChIKey NHDZXGGQRLZRMY-WJMWBRGCSA-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 CGX4nevRTo4
Name 8,13-Epoxy-7a,813,13a-tetrahydro-14H-dibnezo[a,I]thioxanthene
Alternate Name(s) (2S,15S)-23-oxa-14-thiahexacyclo[14.6.1.0(2,15).0(4,13).0(5,10).0(17,22)]tricosa-4,6,8,10,12,17,19,21-octaene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H16OS
InChI InChI=1S/C21H16OS/c1-2-6-13-12(5-1)9-10-18-16(13)11-17-19-14-7-3-4-8-15(14)20(22-19)21(17)23-18/h1-10,17,19-21H,11H2/t17-,19-,20+,21-/m0/s1
InChIKey NHDZXGGQRLZRMY-WJMWBRGCSA-N
Molecular Weight 316.418 g/mol
SMILES [C@@]12([C@@]([C@@]3(O[C@]2(c2c3cccc2)[H])[H])(Sc2c(C1)c1c(cc2)cccc1)[H])[H]
SPLASH splash10-0002-0900000000-92d7cd54d86df9463a1a
Source of Spectrum U-1995-2225-18
Wiley ID 767796