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(13E,15E)-13-chloro-15-(1-chloroethylidene)-14-methyltetracyclo[8.7.2.0(4,16).0(7,12)]nonadeca-1(17),2,4(16),7(12),8,10,13-heptaene
SpectraBase Compound ID 6PhJkfh64SS
InChI InChI=1S/C22H20Cl2/c1-13-21(14(2)23)19-11-15-3-4-16-6-8-18(20(12-16)22(13)24)10-9-17(19)7-5-15/h5-8,11-12H,3-4,9-10H2,1-2H3/b21-14-,22-13+
InChIKey UGYSZIYPWMJNLE-KMNNFWAFSA-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 DJUdBArudNr
Name (13E,15E)-13-chloro-15-(1-chloroethylidene)-14-methyltetracyclo[8.7.2.0(4,16).0(7,12)]nonadeca-1(17),2,4(16),7(12),8,10,13-heptaene
Appearance White solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H20Cl2
InChI InChI=1S/C22H20Cl2/c1-13-21(14(2)23)19-11-15-3-4-16-6-8-18(20(12-16)22(13)24)10-9-17(19)7-5-15/h5-8,11-12H,3-4,9-10H2,1-2H3/b21-14-,22-13+
InChIKey UGYSZIYPWMJNLE-KMNNFWAFSA-N
Instrument Name Finnigan MAT 90X
Ionization Type EI
Literature Reference DOI 10.3762/bjoc.10.266
Molecular Weight 355.308 g/mol
SMILES c12c3cc(cc2)CCc2ccc(c(c2)\C(=C/(\C3=C\(C)Cl)C)Cl)CC1
SPLASH splash10-0v00-0679000000-6305aa1d0d7cc4453663
Source of Spectrum BJO-10-SM7-Compound 13
Thin-Layer Chromatography Rf = 0.42
Wiley ID 1854037