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2,6-Naphthalenedicarboxylic acid

View entire compound with spectra: 2 NMR, 4 FTIR, 1 Raman, and 2 MS (GC)

2,6-Naphthalenedicarboxylic acid
SpectraBase Compound ID B4XVPnDeNYp
InChI InChI=1S/C12H8O4/c13-11(14)9-3-1-7-5-10(12(15)16)4-2-8(7)6-9/h1-6H,(H,13,14)(H,15,16)
InChIKey RXOHFPCZGPKIRD-UHFFFAOYSA-N
Mol Weight 216.19 g/mol
Molecular Formula C12H8O4
Exact Mass 216.042259 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID A3Mfae4flfr
Name Naphthalene-2,6-dicarboxylic acid
CAS Registry Number 1141-38-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H8O4
InChI InChI=1S/C12H8O4/c13-11(14)9-3-1-7-5-10(12(15)16)4-2-8(7)6-9/h1-6H,(H,13,14)(H,15,16)
InChIKey RXOHFPCZGPKIRD-UHFFFAOYSA-N
Molecular Weight 216.192 g/mol
SMILES OC(c1ccc2cc(C(O)=O)ccc2c1)=O
SPLASH splash10-014i-4980000000-8d904f69c4065d8e38bb
Source of Spectrum JX-2015-0-251
Synonyms 2,6-Naphthalic acid
Wiley ID 1720212