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(5R,7S)-5-(2-Butyl-1,3-dithian-2-yl)-6,7-dihydro-6-phenyl-5H-indeno[5,6-d]-1,3-dioxole
SpectraBase Compound ID 1Os5A7qZdsY
InChI InChI=1S/C17H22O3S2/c1-16(2)14(17(3)21-5-4-6-22-17)10-7-12-13(20-9-19-12)8-11(10)15(16)18/h7-8,14-15,18H,4-6,9H2,1-3H3/t14-,15-/m0/s1
InChIKey WRDQMLQWFXZASJ-GJZGRUSLSA-N
Mol Weight 338.48 g/mol
Molecular Formula C17H22O3S2
Exact Mass 338.101037 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Cifm4eCXyvF
Name (5R,7S)-5-(2-Butyl-1,3-dithian-2-yl)-6,7-dihydro-6-phenyl-5H-indeno[5,6-d]-1,3-dioxole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H22O3S2
InChI InChI=1S/C17H22O3S2/c1-16(2)14(17(3)21-5-4-6-22-17)10-7-12-13(20-9-19-12)8-11(10)15(16)18/h7-8,14-15,18H,4-6,9H2,1-3H3/t14-,15-/m0/s1
InChIKey WRDQMLQWFXZASJ-GJZGRUSLSA-N
Molecular Weight 338.480 g/mol
SMILES O[C@]1(c2c([C@@](C1(C)C)(C1(SCCCS1)C)[H])cc1c(OCO1)c2)[H]
SPLASH splash10-001i-0910000000-990a37b1b8eceb02beb1
Source of Spectrum F-52-14957-14
Synonyms (5R,7S)-5-(2-Methyl-1,3-dithian-2-yl)-6,7-dihydro-6-phenyl-5H-indeno[5,6-d]-1,3-dioxole (5R,7S)-6,6-dimethyl-7-(2-methyl-1,3-dithian-2-yl)-6,7-dihydro-5H-indeno[5,6-d][1,3]dioxol-5-ol trans-7-(2-Methyl-1,3-dithian-2-yl)-6,7-dihydro-6,6-dimethyl-5H-indeno[5,6-d]-1,3-dioxol-5-ol
Wiley ID 799759