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Propanedioic acid, [4-[2-(acetyloxy)ethyl]phenyl]-, diethyl ester
SpectraBase Compound ID IeoamwInQHC
InChI InChI=1S/C17H22O6/c1-4-21-16(19)15(17(20)22-5-2)14-9-7-6-8-13(14)10-11-23-12(3)18/h6-9,15H,4-5,10-11H2,1-3H3
InChIKey ZXDZTZDDECGMAD-UHFFFAOYSA-N
Mol Weight 322.36 g/mol
Molecular Formula C17H22O6
Exact Mass 322.141638 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GpPzMnRFYWm
Name Propanedioic acid, [4-[2-(acetyloxy)ethyl]phenyl]-, diethyl ester
Alternate Name(s) Diethyl 2-{2-[2-(acetyloxy)ethyl]phenyl}malonate Diethyl[(2-acetoxyethyl)phenyl]propanedioate
CAS Registry Number 83026-41-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H22O6
InChI InChI=1S/C17H22O6/c1-4-21-16(19)15(17(20)22-5-2)14-9-7-6-8-13(14)10-11-23-12(3)18/h6-9,15H,4-5,10-11H2,1-3H3
InChIKey ZXDZTZDDECGMAD-UHFFFAOYSA-N
Molecular Weight 322.357 g/mol
SMILES C(c1c(CCOC(=O)C)cccc1)(C(=O)OCC)C(=O)OCC
SPLASH splash10-01pc-0950000000-0f2b028921706cee74ea
Source of Spectrum J-47-4699-0
Wiley ID 1321593