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1,3(2H,4H)-Quinazolinediacetic acid, 2,4-dioxo-
SpectraBase Compound ID DTgAo9LdKGB
InChI InChI=1S/C12H10N2O6/c15-9(16)5-13-8-4-2-1-3-7(8)11(19)14(12(13)20)6-10(17)18/h1-4H,5-6H2,(H,15,16)(H,17,18)
InChIKey NBWBXNSDPQCBIQ-UHFFFAOYSA-N
Mol Weight 278.22 g/mol
Molecular Formula C12H10N2O6
Exact Mass 278.053886 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ku5ymXcIbD0
Name 1,3(2H,4H)-Quinazolinediacetic acid, 2,4-dioxo-
CAS Registry Number 112342-48-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H10N2O6
InChI InChI=1S/C12H10N2O6/c15-9(16)5-13-8-4-2-1-3-7(8)11(19)14(12(13)20)6-10(17)18/h1-4H,5-6H2,(H,15,16)(H,17,18)
InChIKey NBWBXNSDPQCBIQ-UHFFFAOYSA-N
Molecular Weight 278.220 g/mol
SMILES OC(CN1C(N(CC(=O)O)C(c2c1cccc2)=O)=O)=O
SPLASH splash10-001i-1910000000-99b8d92bbed161f39cb6
Source of Spectrum AH-118-78-11
Synonyms (1-(carboxymethyl)-2,4-dioxo-1,4-dihydro-3(2H)-quinazolinyl)acetic acid 1,2,3,4-Tetrahydro-2,4-dioxoquinazoline-1,3-diacetic acid
Wiley ID 1281505