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6,9-Methano-7H-[1]benzothiopyrano[3,4-b]furan, 5a,6,8,9,9a,9b-hexahydro-4-phenyl-
SpectraBase Compound ID 4Ys0QnvBl7s
InChI InChI=1S/C18H18OS/c1-2-4-11(5-3-1)18-16-14(8-9-19-16)15-12-6-7-13(10-12)17(15)20-18/h1-5,8-9,12-15,17H,6-7,10H2
InChIKey WDLNCFHYTKCXJT-UHFFFAOYSA-N
Mol Weight 282.4 g/mol
Molecular Formula C18H18OS
Exact Mass 282.107836 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AH8xVYAG6e4
Name 6,9-Methano-7H-[1]benzothiopyrano[3,4-b]furan, 5a,6,8,9,9a,9b-hexahydro-4-phenyl-
Alternate Name(s) 8-phenyl-6-oxa-9-thiatetracyclo[9.2.1.0(2,10).0(3,7)]tetradeca-4,7-diene exo-4-phenyl-6-oxa-3-thiatetracyclo[9.2.1.0(2,10).0(5,9)]tetradeca-4,7-diene
CAS Registry Number 77868-69-0
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H18OS
InChI InChI=1S/C18H18OS/c1-2-4-11(5-3-1)18-16-14(8-9-19-16)15-12-6-7-13(10-12)17(15)20-18/h1-5,8-9,12-15,17H,6-7,10H2
InChIKey WDLNCFHYTKCXJT-UHFFFAOYSA-N
Molecular Weight 282.401 g/mol
SMILES C1(=C2C(C=CO2)C2C(S1)C1CC2CC1)c1ccccc1
SPLASH splash10-000i-0920000000-eeb20b880e12add48021
Source of Spectrum AJ-57-1135-5
Wiley ID 1286220