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3(4H)-Quinazolineacetic acid, 6-chloro-4-oxo-
SpectraBase Compound ID QCA7J4D3Jv
InChI InChI=1S/C10H7ClN2O3/c11-6-1-2-8-7(3-6)10(16)13(5-12-8)4-9(14)15/h1-3,5H,4H2,(H,14,15)
InChIKey YEMHBURPGKVPNM-UHFFFAOYSA-N
Mol Weight 238.63 g/mol
Molecular Formula C10H7ClN2O3
Exact Mass 238.01452 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 85K6RlFwnYV
Name 3(4H)-Quinazolineacetic acid, 6-chloro-4-oxo-
CAS Registry Number 83798-86-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H7ClN2O3
InChI InChI=1S/C10H7ClN2O3/c11-6-1-2-8-7(3-6)10(16)13(5-12-8)4-9(14)15/h1-3,5H,4H2,(H,14,15)
InChIKey YEMHBURPGKVPNM-UHFFFAOYSA-N
Molecular Weight 238.630 g/mol
SMILES OC(CN1C(c2cc(Cl)ccc2N=C1)=O)=O
SPLASH splash10-029f-0920000000-04ca4177a03b6b981e9a
Source of Spectrum O-20-185-2
Synonyms (6-chloro-4-oxo-3(4H)-quinazolinyl)acetic acid 6-Chloro-3,4-dihydroquinazolin-4-on-3-yl-acetic acid 2-(6-Chloro-4-oxo-3-quinazolinyl)acetic acid 2-(6-Chloro-4-oxoquinazolin-3-yl)acetic acid 2-(6-Chloro-4-oxo-quinazolin-3-yl)acetic acid 2-(6-Chloranyl-4-oxidanylidene-quinazolin-3-yl)ethanoic acid
Wiley ID 1240043