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12c-Ethynyl-4,8,12-tri-n-propyl-4,8,12-triazatriangulene
SpectraBase Compound ID Df0yzKOHFsE
InChI InChI=1S/C30H31N3/c1-5-18-31-21-12-9-14-23-27(21)30(8-4)28-22(31)13-10-15-24(28)33(20-7-3)26-17-11-16-25(29(26)30)32(23)19-6-2/h4,9-17H,5-7,18-20H2,1-3H3
InChIKey NOSZZPHOOQHHPG-UHFFFAOYSA-N
Mol Weight 433.6 g/mol
Molecular Formula C30H31N3
Exact Mass 433.251798 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8wDjlBkluY6
Name 12c-Ethynyl-4,8,12-tri-n-propyl-4,8,12-triazatriangulene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H31N3
InChI InChI=1S/C30H31N3/c1-5-18-31-21-12-9-14-23-27(21)30(8-4)28-22(31)13-10-15-24(28)33(20-7-3)26-17-11-16-25(29(26)30)32(23)19-6-2/h4,9-17H,5-7,18-20H2,1-3H3
InChIKey NOSZZPHOOQHHPG-UHFFFAOYSA-N
Molecular Weight 433.599 g/mol
SMILES C12(c3c4cccc3N(c3c1c(N(CCC)c1c2c(N4CCC)ccc1)ccc3)CCC)C#C
SPLASH splash10-0a4i-0011900000-8b9eb6523a9aa330f4dd
Source of Spectrum U1-2010-5049-2a
Wiley ID 1664325