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Spiro[4H-3,1-benzoxathiin-2,1'-cyclooctan]-2'-one
SpectraBase Compound ID 6HLBRgb6grj
InChI InChI=1S/C15H18O2S/c16-14-9-3-1-2-6-10-15(14)17-11-12-7-4-5-8-13(12)18-15/h4-5,7-8H,1-3,6,9-11H2
InChIKey QMDAFWBMYBZBNE-UHFFFAOYSA-N
Mol Weight 262.37 g/mol
Molecular Formula C15H18O2S
Exact Mass 262.102751 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F7hIvzI2ae0
Name Spiro[4H-3,1-benzoxathiin-2,1'-cyclooctan]-2'-one
CAS Registry Number 124921-67-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H18O2S
InChI InChI=1S/C15H18O2S/c16-14-9-3-1-2-6-10-15(14)17-11-12-7-4-5-8-13(12)18-15/h4-5,7-8H,1-3,6,9-11H2
InChIKey QMDAFWBMYBZBNE-UHFFFAOYSA-N
Molecular Weight 262.367 g/mol
SMILES C12(Sc3ccccc3CO2)C(=O)CCCCCC1
SPLASH splash10-00di-0910000000-f3a79b4f461d2502b3f3
Source of Spectrum K-123-1147-4
Synonyms 4H-spiro[3,1-benzoxathiine-2,1'-cyclooctane]-2'-one
Wiley ID 1265785