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6a,7,8,9,10,11,12,12a-Octahydro-5-phenyl-5H-cycloocta[c]-2-benzothiopyran
SpectraBase Compound ID 6uLdLZdumiR
InChI InChI=1S/C21H24S/c1-2-7-15-20-18(13-6-1)17-12-8-9-14-19(17)21(22-20)16-10-4-3-5-11-16/h3-5,8-12,14,18,20-21H,1-2,6-7,13,15H2
InChIKey LHDGZEOXZZDYIQ-UHFFFAOYSA-N
Mol Weight 308.48 g/mol
Molecular Formula C21H24S
Exact Mass 308.159872 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IYq0zG5dXDo
Name 6a,7,8,9,10,11,12,12a-Octahydro-5-phenyl-5H-cycloocta[c]-2-benzothiopyran
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H24S
InChI InChI=1S/C21H24S/c1-2-7-15-20-18(13-6-1)17-12-8-9-14-19(17)21(22-20)16-10-4-3-5-11-16/h3-5,8-12,14,18,20-21H,1-2,6-7,13,15H2
InChIKey LHDGZEOXZZDYIQ-UHFFFAOYSA-N
Molecular Weight 308.483 g/mol
SMILES C1(SC2C(c3ccccc13)CCCCCC2)c1ccccc1
SPLASH splash10-05ox-7913000000-ebee4ac2de3842baa786
Source of Spectrum F-53-969-20
Synonyms 5-Phenyl-6a,7,8,9,10,11,12,12a-octahydro-5H-cycloocta[c][2]benzothiopyran
Wiley ID 800180