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3,3,12,12-Tetradeuterio-2,13-dithia[4.4]orthocyclophane S,S,S',S'-tetraoxide
SpectraBase Compound ID 9SO1UiXpOKA
InChI InChI=1S/C18H20O4S2/c19-23(20)11-9-15-5-1-2-6-16(15)10-12-24(21,22)14-18-8-4-3-7-17(18)13-23/h1-8H,9-14H2/i11D2,12D2
InChIKey OPQAMJDSTBHAGF-AREBVXNXSA-N
Mol Weight 368.5 g/mol
Molecular Formula C18H16D4O4S2
Exact Mass 368.105408 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B6ohop9waPO
Name 3,3,12,12-Tetradeuterio-2,13-dithia[4.4]orthocyclophane S,S,S',S'-tetraoxide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H16D4O4S2
InChI InChI=1S/C18H20O4S2/c19-23(20)11-9-15-5-1-2-6-16(15)10-12-24(21,22)14-18-8-4-3-7-17(18)13-23/h1-8H,9-14H2/i11D2,12D2
InChIKey OPQAMJDSTBHAGF-AREBVXNXSA-N
Molecular Weight 368.498 g/mol
SMILES C1(S(Cc2c(CS(C(Cc3c(C1)cccc3)([D])[D])(=O)=O)cccc2)(=O)=O)([D])[D]
SPLASH splash10-0udr-0900000000-60da61e3feffb88ae9d1
Source of Spectrum AJ-66-1241-6
Wiley ID 772051