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25,26,27,28-Tetrathiapentacyclo[20.2.1.1(4,7).1(10,13).1(16,19)]octacosa-1, 3,5,7,9,11,13,15,17,19,21,23-dodecaene
SpectraBase Compound ID KlBHlmt4ZVr
InChI InChI=1S/C24H16S4/c1-2-18-11-12-20-5-6-22(27-20)15-16-24-8-7-23(28-24)14-13-21-4-3-19(26-21)10-9-17(1)25-18/h1-16H/b10-9-,12-11-,14-13-,16-15-,17-9-,18-11-,19-10-,20-12-,21-13-,22-15-,23-14+,24-16+
InChIKey XNPJBHWLQAWMEN-CVRNVXIMSA-N
Mol Weight 432.6 g/mol
Molecular Formula C24H16S4
Exact Mass 432.013485 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JmiP8HDCfxj
Name 25,26,27,28-Tetrathiapentacyclo[20.2.1.1(4,7).1(10,13).1(16,19)]octacosa-1, 3,5,7,9,11,13,15,17,19,21,23-dodecaene
Alternate Name(s) (2,5)thiophenophanetetraene
CAS Registry Number 64689-90-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H16S4
InChI InChI=1S/C24H16S4/c1-2-18-11-12-20-5-6-22(27-20)15-16-24-8-7-23(28-24)14-13-21-4-3-19(26-21)10-9-17(1)25-18/h1-16H/b10-9-,12-11-,14-13-,16-15-,17-9-,18-11-,19-10-,20-12-,21-13-,22-15-,23-14+,24-16+
InChIKey XNPJBHWLQAWMEN-CVRNVXIMSA-N
Molecular Weight 432.632 g/mol
SMILES C=1\C2=C\C=C\3S\C(=C/C=C/4S\C(=C\C=C\5S\C(=C/C=C/(C1)S2)C=C5)C=C4)C=C3
SPLASH splash10-001i-0001900000-e3b732055d81b2d5be22
Source of Spectrum SB-31-523-0
Wiley ID 1382258