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phenanthro[9,10-b]-1,4-oxathiino[b]pyran-S-oxide

View entire compound with spectra: 1 MS (GC)

phenanthro[9,10-b]-1,4-oxathiino[b]pyran-S-oxide
SpectraBase Compound ID 2rq045uEctO
InChI InChI=1S/C19H16O3S/c20-23-16-10-5-11-21-19(16)22-17-14-8-3-1-6-12(14)13-7-2-4-9-15(13)18(17)23/h1-4,6-9,16,19H,5,10-11H2/t16-,19-,23?/m1/s1
InChIKey DASVHFNHLJDMFF-FVFSQFTHSA-N
Mol Weight 324.39 g/mol
Molecular Formula C19H16O3S
Exact Mass 324.082016 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F0VEykWnCi7
Name phenanthro[9,10-b]-1,4-oxathiino[b]pyran-S-oxide
Alternate Name(s) 11,12,13,13a-tetrahydro-9aH-phenanthro[9,10-b]pyrano[3,2-e][1,4]oxathiin 14-oxide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H16O3S
InChI InChI=1S/C19H16O3S/c20-23-16-10-5-11-21-19(16)22-17-14-8-3-1-6-12(14)13-7-2-4-9-15(13)18(17)23/h1-4,6-9,16,19H,5,10-11H2/t16-,19-,23?/m1/s1
InChIKey DASVHFNHLJDMFF-FVFSQFTHSA-N
Molecular Weight 324.394 g/mol
SMILES c12[S+]([C@]3([C@@](Oc2c2ccccc2c2c1cccc2)(OCCC3)[H])[H])[O-]
SPLASH splash10-0006-0090000000-44227926769bb3d249b0
Source of Spectrum F-52-12252-10
Wiley ID 798762