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1,4-Naphthalenedicarboxylic acid
SpectraBase Compound ID Ci8d5SvVt8P
InChI InChI=1S/C12H8O4/c13-11(14)9-5-6-10(12(15)16)8-4-2-1-3-7(8)9/h1-6H,(H,13,14)(H,15,16)
InChIKey ABMFBCRYHDZLRD-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 5eskE2pMn1S
Name Naphthalene-1,4-dicarboxlic acid
Alternate Name(s) 1,4-Naphthalenedicarboxylic acid Naphthalene-1,4-dicarboxylic acid
CAS Registry Number 605-70-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H8O4
InChI InChI=1S/C12H8O4/c13-11(14)9-5-6-10(12(15)16)8-4-2-1-3-7(8)9/h1-6H,(H,13,14)(H,15,16)
InChIKey ABMFBCRYHDZLRD-UHFFFAOYSA-N
Molecular Weight 216.192 g/mol
SMILES OC(c1c2ccccc2c(C(=O)O)cc1)=O
SPLASH splash10-014i-5960000000-eac88ad12d597811f301
Wiley ID 1474117