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14,17-Bis(chloromethyl)[4.2]paracyclophane-6,9-dicarboxylic acid dimethyl ester
SpectraBase Compound ID 4eoJIpyVgXw
InChI InChI=1S/C24H26Cl2O4/c1-29-23(27)21-12-18-8-7-16-10-19(13-25)15(9-20(16)14-26)5-3-4-6-17(21)11-22(18)24(28)30-2/h9-12H,3-8,13-14H2,1-2H3
InChIKey CIINTPUYSWVFKC-UHFFFAOYSA-N
Mol Weight 449.37 g/mol
Molecular Formula C24H26Cl2O4
Exact Mass 448.120815 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 18dKKqtASNA
Name 14,17-Bis(chloromethyl)[4.2]paracyclophane-6,9-dicarboxylic acid dimethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H26Cl2O4
InChI InChI=1S/C24H26Cl2O4/c1-29-23(27)21-12-18-8-7-16-10-19(13-25)15(9-20(16)14-26)5-3-4-6-17(21)11-22(18)24(28)30-2/h9-12H,3-8,13-14H2,1-2H3
InChIKey CIINTPUYSWVFKC-UHFFFAOYSA-N
Molecular Weight 449.374 g/mol
SMILES c1(c2cc(c(c1)CCCCc1cc(c(CC2)cc1CCl)CCl)C(=O)OC)C(=O)OC
SPLASH splash10-0cfu-0619400000-80f78e3914a25f10911b
Source of Spectrum U1-2009-251-40d
Wiley ID 1662351