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1,2,17,18-Tetraazacyclohexatriaconta-2,4,6,12,14,16,18,20,22,24,30,32,34,36-tetradecaene-8,10,26,28-tetrayne, 7,12,25,30-tetramethyl-, (?,?,?,?,E,E,E,E,Z,Z,Z,Z,E,E)-
SpectraBase Compound ID HZwA8yuJvUE
InChI InChI=1S/C36H32N4/c1-33-21-9-5-7-17-29-37-39-31-19-15-27-35(3)25-13-14-26-36(4)28-16-20-32-40-38-30-18-8-6-10-22-34(2)24-12-11-23-33/h5-10,15-22,27-32H,1-4H3/b7-5-,8-6-,9-5-,10-6-,17-7-,18-8-,19-15-,20-16-,21-9-,22-10-,27-15-,28-16-,29-17-,30-18-,31-19-,32-20-,33-21-,34-22-,35-27-,36-28-,37-29-,38-30-,39-31-,39-37-,40-32-,40-38-
InChIKey QWQBRLCJMCZGHZ-RSYNOOKXSA-N
Mol Weight 520.7 g/mol
Molecular Formula C36H32N4
Exact Mass 520.262697 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2cX6awbxsGT
Name 1,2,17,18-Tetraazacyclohexatriaconta-2,4,6,12,14,16,18,20,22,24,30,32,34,36-tetradecaene-8,10,26,28-tetrayne, 7,12,25,30-tetramethyl-, (?,?,?,?,E,E,E,E,Z,Z,Z,Z,E,E)-
CAS Registry Number 87021-50-9
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C36H32N4
InChI InChI=1S/C36H32N4/c1-33-21-9-5-7-17-29-37-39-31-19-15-27-35(3)25-13-14-26-36(4)28-16-20-32-40-38-30-18-8-6-10-22-34(2)24-12-11-23-33/h5-10,15-22,27-32H,1-4H3/b7-5-,8-6-,9-5-,10-6-,17-7-,18-8-,19-15-,20-16-,21-9-,22-10-,27-15-,28-16-,29-17-,30-18-,31-19-,32-20-,33-21-,34-22-,35-27-,36-28-,37-29-,38-30-,39-31-,39-37-,40-32-,40-38-
InChIKey QWQBRLCJMCZGHZ-RSYNOOKXSA-N
Molecular Weight 520.680 g/mol
SMILES C#1\C(=C/C=C\C=N/N=C\C=C/C=C\C=C/(C#[C]=[C]#C\C(=C/C=C\C=C/C=N\N=C/C=C\C=C/(C#[C]=[C]1)C)C)C)C
SPLASH splash10-014i-0900030000-6a5ca603742354084932
Source of Spectrum AJ-56-1473-32
Synonyms (1Z,12Z,14Z,16Z,22Z,24Z,32Z)-7,12,25,30-tetramethyl-1,2,17,18-tetraazacyclohexatriaconta-1(36),2,4,6,9,12,14,16,18,20,22,24,27,30,32,34-hexadecaen-8,10,26,28-tetrayne 7,12,25,30-Tetramethyl-1,2,17,18-tetraaza[36]annulene-2,4,6,12,14,16,18,20,22,24,30,32,34,36-tetradecaene-8,10,26,28-tetrayne
Wiley ID 1402076