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2,3-Naphthalenedicarboxylic acid, 1-(phenyl-D5)-, dimethyl ester
SpectraBase Compound ID FBODcI12P5C
InChI InChI=1S/C20H16O4/c1-23-19(21)16-12-14-10-6-7-11-15(14)17(18(16)20(22)24-2)13-8-4-3-5-9-13/h3-12H,1-2H3/i3D,4D,5D,8D,9D
InChIKey BOIIYZDAURHCJU-YQYLVRRTSA-N
Mol Weight 325.37 g/mol
Molecular Formula C20H112D5O4
Exact Mass 325.136243 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HN1G4THL3KU
Name 2,3-Naphthalenedicarboxylic acid, 1-(phenyl-D5)-, dimethyl ester
CAS Registry Number 129957-24-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H11D5O4
InChI InChI=1S/C20H16O4/c1-23-19(21)16-12-14-10-6-7-11-15(14)17(18(16)20(22)24-2)13-8-4-3-5-9-13/h3-12H,1-2H3/i3D,4D,5D,8D,9D
InChIKey BOIIYZDAURHCJU-YQYLVRRTSA-N
Molecular Weight 325.375 g/mol
SMILES c1(c(cc2c(c1-c1c(c([2D])c(c(c1[2D])[2D])[2D])[2D])cccc2)C(=O)OC)C(=O)OC
SPLASH splash10-002f-0095000000-b5223e12678e3813b345
Source of Spectrum B-43-1149-24
Synonyms Dimethyl 1-(pentadeuterio)naphthalene-2,3-dicarboxylate
Wiley ID 1320338