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5-Ethynylbenzene-1,3-dicarboxylic acid dimethyl ester
SpectraBase Compound ID 4XVFcIaYkmt
InChI InChI=1S/C12H10O4/c1-4-8-5-9(11(13)15-2)7-10(6-8)12(14)16-3/h1,5-7H,2-3H3
InChIKey RSSODPUFUQKWIK-UHFFFAOYSA-N
Mol Weight 218.21 g/mol
Molecular Formula C12H10O4
Exact Mass 218.057909 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L1so7n0FZW6
Name 5-Ethynylbenzene-1,3-dicarboxylic acid dimethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H10O4
InChI InChI=1S/C12H10O4/c1-4-8-5-9(11(13)15-2)7-10(6-8)12(14)16-3/h1,5-7H,2-3H3
InChIKey RSSODPUFUQKWIK-UHFFFAOYSA-N
Molecular Weight 218.208 g/mol
SMILES c1(C(=O)OC)cc(C(=O)OC)cc(C#C)c1
SPLASH splash10-00kr-0940000000-e9defaabab316edc20a3
Source of Spectrum F-56-8342-29
Synonyms Dimethyl 5-ethynylbenzene-1,3-dicarboxylate
Wiley ID 859044