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3,5,7,9,12,14,16-Nonadecaheptaene-1,18-diyne, 11-(dichloromethylene)-3,17-dimethyl-, (E,E,Z,Z,E,E,E)-
SpectraBase Compound ID H6XSrFYzHe3
InChI InChI=1S/C22H20Cl2/c1-5-19(3)15-11-8-7-9-13-17-21(22(23)24)18-14-10-12-16-20(4)6-2/h1-2,7-18H,3-4H3/b9-7-,11-8+,12-10+,17-13-,18-14+,19-15+,20-16+
InChIKey OLPDGYTXEJTYRN-GEWGINRZSA-N
Mol Weight 355.31 g/mol
Molecular Formula C22H20Cl2
Exact Mass 354.094206 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9YNaUP6tThw
Name 3,5,7,9,12,14,16-Nonadecaheptaene-1,18-diyne, 11-(dichloromethylene)-3,17-dimethyl-, (E,E,Z,Z,E,E,E)-
Alternate Name(s) (3E,5E,7Z,9Z,12E,14E,16E)-11-(dichloromethylene)-3,17-dimethyl-3,5,7,9,12,14,16-nonadecaheptaene-1,18-diyne 9-Dichloromethylene-3,17-dimethylnonadeca-3,5,7,10,12,14,16-heptaene-1,18-diyne
CAS Registry Number 89004-96-6
Comments Less than 3 mono-isotopic peaks
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Formula C22H20Cl2
InChI InChI=1S/C22H20Cl2/c1-5-19(3)15-11-8-7-9-13-17-21(22(23)24)18-14-10-12-16-20(4)6-2/h1-2,7-18H,3-4H3/b9-7-,11-8+,12-10+,17-13-,18-14+,19-15+,20-16+
InChIKey OLPDGYTXEJTYRN-GEWGINRZSA-N
Molecular Weight 355.308 g/mol
SMILES C(=C(\C=C/C=C\C=C\C=C\(C#C)C)\C=C\C=C\C=C\(C#C)C)(Cl)Cl
SPLASH splash10-0kdi-0509000000-1c2712f6c17f37abd619
Source of Spectrum KC-1983-3002-0
Wiley ID 1344837