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15,29-Bis(dicyanomethylene)-5,8,21,24-pentaoxa-2,11,18,27-tetrathiatricyclo[19.4..1(12,17)]tritriacontanesa-1(32),12(18),13,16,28(33),30-hexaene
SpectraBase Compound ID 5OiTPmp9lHG
InChI InChI=1S/C32H32N4O4S4/c33-21-26(22-34)25-4-5-29-19-30(18-25)43-16-12-39-8-9-40-13-17-44-32-20-28(2-1-3-31(32)27(23-35)24-36)41-14-10-37-6-7-38-11-15-42-29/h1-5,18-20H,6-17H2
InChIKey SSGRAKWPWKJPGF-UHFFFAOYSA-N
Mol Weight 664.9 g/mol
Molecular Formula C32H32N4O4S4
Exact Mass 664.13064 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Cz6TMFACJyi
Name 15,29-Bis(dicyanomethylene)-5,8,21,24-pentaoxa-2,11,18,27-tetrathiatricyclo[19.4..1(12,17)]tritriacontanesa-1(32),12(18),13,16,28(33),30-hexaene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C32H32N4O4S4
InChI InChI=1S/C32H32N4O4S4/c33-21-26(22-34)25-4-5-29-19-30(18-25)43-16-12-39-8-9-40-13-17-44-32-20-28(2-1-3-31(32)27(23-35)24-36)41-14-10-37-6-7-38-11-15-42-29/h1-5,18-20H,6-17H2
InChIKey SSGRAKWPWKJPGF-UHFFFAOYSA-N
Molecular Weight 664.872 g/mol
SMILES C1=2C(=C(C#N)C#N)C=CC=C(C2)SCCOCCOCCSC2=CC(SCCOCCOCCS1)=CC(=C(C#N)C#N)C=C2
SPLASH splash10-03dj-9000000000-09d35b495e305dc1eeea
Source of Spectrum AJ-67-1098-8
Synonyms 15,29-Bis(dicyanomethylene)-5,8,21,24-pentaoxa-2,11,18,27-tetrathiatricyclo[26.4..1(12,17)]tetratriacontanesa-1(32),12(34),13,16,28(33),30-hexaene 2-[31-(dicyanomethylene)-5,8,21,24-tetraoxa-2,11,18,27-tetrathiatricyclo[26.4.1.1(12,17)]tetratriaconta-1(32),12(34),14,16,28(33),29-hexaen-13-ylidene]malononitrile
Wiley ID 772501