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5,7 : 14,16-bis ( 1',3'-Adamantano)-1,2,10,11-tetrathiacyclooctadecane

View entire compound with spectra: 1 MS (GC)

5,7 : 14,16-bis ( 1',3'-Adamantano)-1,2,10,11-tetrathiacyclooctadecane
SpectraBase Compound ID 2JOLLdVwHPD
InChI InChI=1S/C28H44S4/c1-5-29-30-6-3-27-15-23-10-24(16-27)18-28(17-23,20-27)4-8-32-31-7-2-26-13-21-9-22(14-26)12-25(1,11-21)19-26/h21-24H,1-20H2/t21-,22+,23-,24+,25-,26+,27-,28+
InChIKey HDBFGWCZNJFZKS-KBTOGVQVSA-N
Mol Weight 508.9 g/mol
Molecular Formula C28H44S4
Exact Mass 508.232586 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 55eoPFE3uAq
Name 5,7 : 14,16-bis ( 1',3'-Adamantano)-1,2,10,11-tetrathiacyclooctadecane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H44S4
InChI InChI=1S/C28H44S4/c1-5-29-30-6-3-27-15-23-10-24(16-27)18-28(17-23,20-27)4-8-32-31-7-2-26-13-21-9-22(14-26)12-25(1,11-21)19-26/h21-24H,1-20H2/t21-,22+,23-,24+,25-,26+,27-,28+
InChIKey HDBFGWCZNJFZKS-KBTOGVQVSA-N
Molecular Weight 508.900 g/mol
SMILES [C@]123C[C@@]4(CCSSCC[C@@]56C[C@]7(CCSSCC3)C[C@](C6)(C[C@@](C7)(C5)[H])[H])C[C@@](C2)(C[C@@](C1)(C4)[H])[H]
SPLASH splash10-0a4i-0060090000-41d6e4abb0e949b80b03
Source of Spectrum K-127-1329-3
Synonyms 4,5,17,18-tetrathiaheptacyclo[19.5.1.1(1,23).1(8,12).1(8,14).1(10,14).1(21,25)]dotriacontane
Wiley ID 1400182