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Dispiro[1,3-dithiane-2,2'-tricyclo[9.3.1.1(4,8)]hexadeca[1(15),4,6,8(16),11,13]hexaene-10',2''-[1,3]dithiolane]
SpectraBase Compound ID ICQ2GsLCjM9
InChI InChI=1S/C21H22S4/c1-4-16-12-17(5-1)15-21(24-10-11-25-21)19-7-2-6-18(13-19)20(14-16)22-8-3-9-23-20/h1-2,4-7,12-13H,3,8-11,14-15H2
InChIKey NXJPLGWXQXPXJV-UHFFFAOYSA-N
Mol Weight 402.6 g/mol
Molecular Formula C21H22S4
Exact Mass 402.060435 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Io10bcN6K6V
Name Dispiro[1,3-dithiane-2,2'-tricyclo[9.3.1.1(4,8)]hexadeca[1(15),4,6,8(16),11,13]hexaene-10',2''-[1,3]dithiolane]
Alternate Name(s) 1,10-Dioxo-[2.2]metacyclophane-ethylene-propylenethioacetal dispiro[1,3-dithiane-2,2'-tricyclo[9.3.1.1(4,8)]hexadecane-10',2''-[1,3]dithiolane]-1'(15'),4',6',8'(16'),11',13'-hexaene Dispiro[1,3-dithiane-2,2'-tricyclo[9.3.1.1(4,8)]hexadeca[1(15),4,6,8(16),11,13]hexaene-10',2''-[1,3]dithiolane]
CAS Registry Number 55894-64-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H22S4
InChI InChI=1S/C21H22S4/c1-4-16-12-17(5-1)15-21(24-10-11-25-21)19-7-2-6-18(13-19)20(14-16)22-8-3-9-23-20/h1-2,4-7,12-13H,3,8-11,14-15H2
InChIKey NXJPLGWXQXPXJV-UHFFFAOYSA-N
Molecular Weight 402.647 g/mol
SMILES C12(c3cc(C4(SCCCS4)Cc4cc(C1)ccc4)ccc3)SCCS2
SPLASH splash10-0f6t-0190200000-9ea3779df30908fe1c81
Source of Spectrum AH-106-200-12
Wiley ID 1370305