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(3aR,4S)-3a-methyl-4-phenyl-4H-oxathiolo[5,4-c]chromene 2,2-dioxide
SpectraBase Compound ID DntwbktoLzP
InChI InChI=1S/C17H14O4S/c1-17-14(11-22(18,19)21-17)13-9-5-6-10-15(13)20-16(17)12-7-3-2-4-8-12/h2-11,16H,1H3/t16-,17+/m0/s1
InChIKey KPDKHDDPAVLSEQ-DLBZAZTESA-N
Mol Weight 314.36 g/mol
Molecular Formula C17H14O4S
Exact Mass 314.06128 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID PforpeGwLo
Name (3aR,4S)-3a-methyl-4-phenyl-4H-oxathiolo[5,4-c]chromene 2,2-dioxide
Alternate Name(s) (3aR,4S)-3a-methyl-4-phenyl-4H-oxathiolo[5,4-c][1]benzopyran 2,2-dioxide (3aR,4S)-3a-methyl-4-phenyl-4H-[1,2]oxathiolo[5,4-c]chromene 2,2-dioxide
CAS Registry Number 116703-62-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H14O4S
InChI InChI=1S/C17H14O4S/c1-17-14(11-22(18,19)21-17)13-9-5-6-10-15(13)20-16(17)12-7-3-2-4-8-12/h2-11,16H,1H3/t16-,17+/m0/s1
InChIKey KPDKHDDPAVLSEQ-DLBZAZTESA-N
Molecular Weight 314.355 g/mol
SMILES [C@]12(OS(C=C1c1c(O[C@]2(c2ccccc2)[H])cccc1)(=O)=O)C
SPLASH splash10-0pdj-3790000000-3d76ecc7133251d7ffe6
Source of Spectrum Y-25-345-5
Wiley ID 1314950