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31-Methyl-7,22-diethyl-1,7,13,16,22,28-hexaazatricyclo[22,3,1,1(13,16)]tritriaconta-30-ene-15,29,32,33-tetraone
SpectraBase Compound ID 6ONwd4vEgWK
InChI InChI=1S/C32H56N6O4/c1-4-33-18-10-6-14-22-35-27-30(40)38(31(35)41)25-17-9-13-21-34(5-2)20-12-8-16-24-37-29(39)26-28(3)36(32(37)42)23-15-7-11-19-33/h26H,4-25,27H2,1-3H3
InChIKey VTZPITNHJXXBCJ-UHFFFAOYSA-N
Mol Weight 588.8 g/mol
Molecular Formula C32H56N6O4
Exact Mass 588.436304 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7BSx6WBjKl9
Name 31-Methyl-7,22-diethyl-1,7,13,16,22,28-hexaazatricyclo[22,3,1,1(13,16)]tritriaconta-30-ene-15,29,32,33-tetraone
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Formula C32H56N6O4
InChI InChI=1S/C32H56N6O4/c1-4-33-18-10-6-14-22-35-27-30(40)38(31(35)41)25-17-9-13-21-34(5-2)20-12-8-16-24-37-29(39)26-28(3)36(32(37)42)23-15-7-11-19-33/h26H,4-25,27H2,1-3H3
InChIKey VTZPITNHJXXBCJ-UHFFFAOYSA-N
Molecular Weight 588.838 g/mol
SMILES C1(N2C(=O)C=C(N1CCCCCN(CC)CCCCCN1C(=O)N(CCCCCN(CCCCC2)CC)C(=O)C1)C)=O
SPLASH splash10-052r-1100090000-d040cc7d018ddf186528
Source of Spectrum O1-46-310-3a
Wiley ID 1669194