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5,5,20,20-Tetracyano-14,17,20,23-tetraoxa-25-thiatricyclo[24.2.1]tetradeca-1,3,8,10-tetraene
SpectraBase Compound ID qsO17jRiwl
InChI InChI=1S/C24H22N4OS/c25-15-23(16-26)11-1-2-13-29-14-10-22-8-7-21(30-22)9-12-24(17-27,18-28)20-5-3-19(23)4-6-20/h3-8H,1-2,9-14H2
InChIKey QSXPCIMADRZBKZ-UHFFFAOYSA-N
Mol Weight 414.53 g/mol
Molecular Formula C24H22N4OS
Exact Mass 414.151433 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Frivk28UDSa
Name 5,5,20,20-Tetracyano-14,17,20,23-tetraoxa-25-thiatricyclo[24.2.1]tetradeca-1,3,8,10-tetraene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H22N4OS
InChI InChI=1S/C24H22N4OS/c25-15-23(16-26)11-1-2-13-29-14-10-22-8-7-21(30-22)9-12-24(17-27,18-28)20-5-3-19(23)4-6-20/h3-8H,1-2,9-14H2
InChIKey QSXPCIMADRZBKZ-UHFFFAOYSA-N
Molecular Weight 414.527 g/mol
SMILES C1(C#N)(C#N)c2ccc(C(C#N)(C#N)CCCCOCCc3sc(CC1)cc3)cc2
SPLASH splash10-0229-0900200000-0104addb2861a1b3005f
Source of Spectrum J-58-1603-7
Wiley ID 1375460