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MALONIC ACID, BENZYL-, DIETHYL ESTER
SpectraBase Compound ID JnjIvQO7Uqg
InChI InChI=1S/C14H18O4/c1-3-17-13(15)12(14(16)18-4-2)10-11-8-6-5-7-9-11/h5-9,12H,3-4,10H2,1-2H3
InChIKey ICZLTZWATFXDLP-UHFFFAOYSA-N
Mol Weight 250.29 g/mol
Molecular Formula C14H18O4
Exact Mass 250.120509 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7NCvZWArXiX
Name Propanedioic acid, (phenylmethyl)-, diethyl ester
Alternate Name(s) Diethyl 2-benzylmalonate 2-(Phenylmethyl)propanedioic acid diethyl ester 2-Benzylmalonic acid diethyl ester Benzylmalonic acid diethyl ester Diethyl 2-(phenylmethyl)propanedioate Diethyl 2-benzylpropanedioate Malonic acid, 2-benzyl-, diethyl ester Malonic acid, benzyl-, diethyl ester AI3-01359 EINECS 210-142-7 NSC 41169 NSC 8720
CAS Registry Number 607-81-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H18O4
InChI InChI=1S/C14H18O4/c1-3-17-13(15)12(14(16)18-4-2)10-11-8-6-5-7-9-11/h5-9,12H,3-4,10H2,1-2H3
InChIKey ICZLTZWATFXDLP-UHFFFAOYSA-N
Molecular Weight 250.294 g/mol
SMILES C(C(=O)OCC)(C(=O)OCC)Cc1ccccc1
SPLASH splash10-0fal-3900000000-b50af83ed5971f529121
Source of Spectrum W5-21932-0-0
Wiley ID 1253283