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2H-1,4-Benzoxazine, acetic acid deriv.
SpectraBase Compound ID GRjYS9D0YWd
InChI InChI=1S/C10H7NO4/c12-9(13)5-8-10(14)11-6-3-1-2-4-7(6)15-8/h1-5H,(H,11,14)(H,12,13)/b8-5+
InChIKey LVNNJPIVJTUIEK-VMPITWQZSA-N
Mol Weight 205.17 g/mol
Molecular Formula C10H7NO4
Exact Mass 205.037508 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1AoQXcg3mqB
Name 2H-1,4-Benzoxazine, acetic acid deriv.
CAS Registry Number 106660-14-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H7NO4
InChI InChI=1S/C10H7NO4/c12-9(13)5-8-10(14)11-6-3-1-2-4-7(6)15-8/h1-5H,(H,11,14)(H,12,13)/b8-5+
InChIKey LVNNJPIVJTUIEK-VMPITWQZSA-N
Molecular Weight 205.169 g/mol
SMILES N1c2c(O\C(=C\C(=O)O)C1=O)cccc2
SPLASH splash10-0a4i-0930000000-5909e8aeeab70d12cf33
Source of Spectrum B-39-509-3
Synonyms Acetic acid, (3,4-dihydro-3-oxo-2H-1,4-benzoxazin-2-ylidene)-, (E)- (2E)-(3-oxo-3,4-dihydro-2H-1,4-benzoxazin-2-ylidene)ethanoic acid (E)-(3'-oxo-3',4'-dihydro-2'h-1',4'-benzoxazin-2'ylidene)acetic acid
Wiley ID 1203255