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Phthalic acid
SpectraBase Compound ID HL13QHBIO1X
InChI InChI=1S/C8H6O4/c9-7(10)5-3-1-2-4-6(5)8(11)12/h1-4H,(H,9,10)(H,11,12)
InChIKey XNGIFLGASWRNHJ-UHFFFAOYSA-N
Mol Weight 166.13 g/mol
Molecular Formula C8H6O4
Exact Mass 166.026609 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HgNYPXelDca
Name Benzenedicarboxylic acid
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 166.026608669 u
Formula C8H6O4
InChI InChI=1S/C8H6O4/c9-7(10)5-3-1-2-4-6(5)8(11)12/h1-4H,(H,9,10)(H,11,12)
InChIKey XNGIFLGASWRNHJ-UHFFFAOYSA-N
Instrument Name Agilent 7890A-5975C
Ionization Type EI
Literature Reference DOI 10.1002/jsfa.9836
Molecular Weight 166.132 g/mol
Number of Peaks 29
SMILES OC(c1ccccc1C(=O)O)=O
SPLASH splash10-0v00-9400000000-dd1a5352c623be57be71
Source of Spectrum SFA-99-6147-Fig. 4(E) (DOI: 10.1002/jsfa.9836)
Wiley ID 1838705