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trans-3-(2-Butyl-1,3-dithian-2-yl)-2,3-dihydro-2-phenyl-1H-indene
SpectraBase Compound ID IgRPIzJe5JE
InChI InChI=1S/C23H28S2/c1-2-3-14-23(24-15-9-16-25-23)22-20-13-8-7-12-19(20)17-21(22)18-10-5-4-6-11-18/h4-8,10-13,21-22H,2-3,9,14-17H2,1H3/t21-,22+/m1/s1
InChIKey UDMSKYYPGUYPJM-YADHBBJMSA-N
Mol Weight 368.6 g/mol
Molecular Formula C23H28S2
Exact Mass 368.163243 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4BlORrxohdR
Name trans-3-(2-Butyl-1,3-dithian-2-yl)-2,3-dihydro-2-phenyl-1H-indene
Alternate Name(s) 2-Butyl-2-[(1R,2S)-2-phenyl-2,3-dihydro-1H-inden-1-yl]-1,3-dithiane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H28S2
InChI InChI=1S/C23H28S2/c1-2-3-14-23(24-15-9-16-25-23)22-20-13-8-7-12-19(20)17-21(22)18-10-5-4-6-11-18/h4-8,10-13,21-22H,2-3,9,14-17H2,1H3/t21-,22+/m1/s1
InChIKey UDMSKYYPGUYPJM-YADHBBJMSA-N
Molecular Weight 368.597 g/mol
SMILES [C@@]1([C@@](C2(SCCCS2)CCCC)(c2ccccc2C1)[H])(c1ccccc1)[H]
SPLASH splash10-004i-1910000000-1134954b8ce2ddaa9970
Source of Spectrum F-52-14958-18
Wiley ID 799758