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(1,3-Dioxo-3,4-dihydro-2(1H)-isoquinolinyl)acetic acid

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(1,3-Dioxo-3,4-dihydro-2(1H)-isoquinolinyl)acetic acid
SpectraBase Compound ID 8Ee15VGWzAY
InChI InChI=1S/C11H9NO4/c13-9-5-7-3-1-2-4-8(7)11(16)12(9)6-10(14)15/h1-4H,5-6H2,(H,14,15)
InChIKey PNBCSFDZKNXAAK-UHFFFAOYSA-N
Mol Weight 219.2 g/mol
Molecular Formula C11H9NO4
Exact Mass 219.053158 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Fyd1iZNbDY5
Name 2(1H)-ISOQUINOLINEACETIC ACID, 3,4-DIHYDRO-1,3-DIOXO-
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C11H9NO4
InChI InChI=1S/C11H9NO4/c13-9-5-7-3-1-2-4-8(7)11(16)12(9)6-10(14)15/h1-4H,5-6H2,(H,14,15)
InChIKey PNBCSFDZKNXAAK-UHFFFAOYSA-N
Molecular Weight 219.0529
SMILES OC(=O)CN1C(c2ccccc2CC1=O)=O
SPLASH splash10-00mn-6900000000-11cf5c53b1c346aabbf0
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany