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4,5,6A,9B,13B-HEXAHYDRO-3BH-BENZO[2',3']THIENO[2",3":4',5']PENTALENO[1'6':3,4]INDENO[2,1]THIOPHEN-5-ONE
SpectraBase Compound ID 4JMHd9V8YBf
InChI InChI=1S/C22H16OS2/c23-11-9-16-14-5-7-24-20(14)18-12-3-1-2-4-13(12)19-21-15(6-8-25-21)17(10-11)22(16,18)19/h1-8,16-19H,9-10H2/t16-,17?,18+,19?,22?/m1/s1
InChIKey RWQZIWRTJXURQR-OUQWCPNASA-N
Mol Weight 360.49 g/mol
Molecular Formula C22H16OS2
Exact Mass 360.064257 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IQPL53yQt1n
Name 4,5,6A,9B,13B-HEXAHYDRO-3BH-BENZO[2',3']THIENO[2",3":4',5']PENTALENO[1'6':3,4]INDENO[2,1]THIOPHEN-5-ONE
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C22H16OS2
InChI InChI=1S/C22H16OS2/c23-11-9-16-14-5-7-24-20(14)18-12-3-1-2-4-13(12)19-21-15(6-8-25-21)17(10-11)22(16,18)19/h1-8,16-19H,9-10H2/t16-,17?,18+,19?,22?/m1/s1
InChIKey RWQZIWRTJXURQR-OUQWCPNASA-N
Instrument Name AUTOSPEC
Molecular Weight 360.0639
SMILES c1cc2C3c4sccc4C4C33[C@@](c5c(scc5)[C@@]3(c2cc1)[H])(CC(=O)C4)[H]
SPLASH splash10-0j4i-1479000000-dc05032681f5cfae54f5
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany