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Butanedioic acid, 2-benzyl-2-carboxyl-, triethyl ester
SpectraBase Compound ID a2vgW7ROSm
InChI InChI=1S/C18H24O6/c1-4-22-15(19)13-18(16(20)23-5-2,17(21)24-6-3)12-14-10-8-7-9-11-14/h7-11H,4-6,12-13H2,1-3H3
InChIKey RPNRGCZUORVKJF-UHFFFAOYSA-N
Mol Weight 336.38 g/mol
Molecular Formula C18H24O6
Exact Mass 336.157288 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LUnaqW8EfDR
Name Butanedioic acid, 2-benzyl-2-carboxyl-, triethyl ester
CAS Registry Number 109554-51-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H24O6
InChI InChI=1S/C18H24O6/c1-4-22-15(19)13-18(16(20)23-5-2,17(21)24-6-3)12-14-10-8-7-9-11-14/h7-11H,4-6,12-13H2,1-3H3
InChIKey RPNRGCZUORVKJF-UHFFFAOYSA-N
Molecular Weight 336.384 g/mol
SMILES CCOC(=O)C(C(=O)OCC)(Cc1ccccc1)CC(=O)OCC
SPLASH splash10-0gdm-3970000000-aa9f1cdd3425e4a06fbd
Synonyms 1-(Phenylmethyl)ethane-1,1,2-tricarboxylic acid triethyl ester 1-Benzylethane-1,1,2-tricarboxylic acid triethyl ester Triethyl 1-(phenylmethyl)ethane-1,1,2-tricarboxylate Triethyl 1-benzylethane-1,1,2-tricarboxylate Triethyl 3-phenyl-1,2,2-propanetricarboxylate
Wiley ID 1479474