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5,16-Dioxa-2,8,13,19,23,24-hexathia-10,11,21,22-tetraazatricyclo[18.2.1.19,12]tetracosa-9,11,20,22-tetraene
SpectraBase Compound ID FDIgOc7DFB8
InChI InChI=1S/C12H16N4O2S6/c1-5-19-9-13-14-11(23-9)21-7-3-18-4-8-22-12-16-15-10(24-12)20-6-2-17-1/h1-8H2
InChIKey AARWAJGVLHMYBS-UHFFFAOYSA-N
Mol Weight 440.6 g/mol
Molecular Formula C12H16N4O2S6
Exact Mass 439.959753 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CbQTmTAH9jx
Name 5,16-Dioxa-2,8,13,19,23,24-hexathia-10,11,21,22-tetraazatricyclo[18.2.1.19,12]tetracosa-9,11,20,22-tetraene
Alternate Name(s) 2,8,13,19,23,24-Hexathia-5,16-dioxa-10,11,21,22-tetraazatricyclo[18.2.1.1(9,12)]tetracosa-1(22),9,11,20-tetraene 5,16-dioxa-2,8,13,19,23,24-hexathia-10,11,21,22-tetraazatricyclo[18.2.1.1(9,12)]tetracosa-1(22),9,11,20-tetraene
CAS Registry Number 108345-06-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H16N4O2S6
InChI InChI=1S/C12H16N4O2S6/c1-5-19-9-13-14-11(23-9)21-7-3-18-4-8-22-12-16-15-10(24-12)20-6-2-17-1/h1-8H2
InChIKey AARWAJGVLHMYBS-UHFFFAOYSA-N
Molecular Weight 440.646 g/mol
SMILES c12sc(nn2)SCCOCCSc2sc(SCCOCCS1)nn2
SPLASH splash10-00dj-0093200000-5dc5443fd24f758696f7
Source of Spectrum O-22-275-9
Wiley ID 1384525