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Pseudo-para 2,11-Dithia[3,3](2,5)pyrimidinophanes
SpectraBase Compound ID 6zM4p2zrQVA
InChI InChI=1S/C12H12N4S2/c1-9-2-14-11(13-1)7-18-6-10-3-15-12(16-4-10)8-17-5-9/h1-4H,5-8H2
InChIKey KATIQLVCFVZAIX-UHFFFAOYSA-N
Mol Weight 276.38 g/mol
Molecular Formula C12H12N4S2
Exact Mass 276.050339 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9rdVYpriIvw
Name Pseudo-para 2,11-Dithia[3,3](2,5)pyrimidinophanes
CAS Registry Number 126504-95-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H12N4S2
InChI InChI=1S/C12H12N4S2/c1-9-2-14-11(13-1)7-18-6-10-3-15-12(16-4-10)8-17-5-9/h1-4H,5-8H2
InChIKey KATIQLVCFVZAIX-UHFFFAOYSA-N
Molecular Weight 276.376 g/mol
SMILES c12ncc(cn2)CSCc2ncc(CSC1)cn2
SPLASH splash10-0550-2930000000-5ee0004bc564bd204404
Source of Spectrum K-123-1889-17
Synonyms 3,10-dithia-6,13,16,18-tetraazatricyclo[10.2.2.2(5,8)]octadeca-1(14),5,7,12,15,17-hexaene
Wiley ID 1279630