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2-((1S,4R,5S)-5-Benzenesulfonylmethyl-4-benzyloxymethyl-4-methylcyclopent-2-enyl)-2-methyl[1,3]dioxolane

View entire compound with spectra: 1 MS (GC)

2-((1S,4R,5S)-5-Benzenesulfonylmethyl-4-benzyloxymethyl-4-methylcyclopent-2-enyl)-2-methyl[1,3]dioxolane
SpectraBase Compound ID BWisGjcxaYX
InChI InChI=1S/C25H30O5S/c1-24(19-28-17-20-9-5-3-6-10-20)14-13-22(25(2)29-15-16-30-25)23(24)18-31(26,27)21-11-7-4-8-12-21/h3-14,22-23H,15-19H2,1-2H3/t22-,23-,24-/m0/s1
InChIKey JVSTXFAKEUSCFV-HJOGWXRNSA-N
Mol Weight 442.57 g/mol
Molecular Formula C25H30O5S
Exact Mass 442.181395 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9TMySlPVzvi
Name 2-((1S,4R,5S)-5-Benzenesulfonylmethyl-4-benzyloxymethyl-4-methylcyclopent-2-enyl)-2-methyl[1,3]dioxolane
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H30O5S
InChI InChI=1S/C25H30O5S/c1-24(19-28-17-20-9-5-3-6-10-20)14-13-22(25(2)29-15-16-30-25)23(24)18-31(26,27)21-11-7-4-8-12-21/h3-14,22-23H,15-19H2,1-2H3/t22-,23-,24-/m0/s1
InChIKey JVSTXFAKEUSCFV-HJOGWXRNSA-N
Molecular Weight 442.570 g/mol
SMILES C(S(=O)(=O)c1ccccc1)[C@]1([C@@](C2(OCCO2)C)(C=C[C@]1(COCc1ccccc1)C)[H])[H]
SPLASH splash10-000i-9000000000-8a4e9d2d91881246a3f9
Source of Spectrum F-59-69-18
Wiley ID 1676636