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2-Methyl-4-oxo-2,3,4,5-tetrahydro-1,5-benzoxazepine-7-carboxylic acid
SpectraBase Compound ID KLkFY0YlVvi
InChI InChI=1S/C11H11NO4/c1-6-4-10(13)12-8-5-7(11(14)15)2-3-9(8)16-6/h2-3,5-6H,4H2,1H3,(H,12,13)(H,14,15)
InChIKey UTYWAACFFFXNCC-UHFFFAOYSA-N
Mol Weight 221.21 g/mol
Molecular Formula C11H11NO4
Exact Mass 221.068808 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BXX4OOUYsZf
Name 2-Methyl-4-oxo-2,3,4,5-tetrahydro-1,5-benzoxazepine-7-carboxylic acid
Alternate Name(s) 2-Methyl-4-oxidanylidene-3,5-dihydro-2H-1,5-benzoxazepine-7-carboxylic acid 2-Methyl-4-oxo-3,5-dihydro-2H-1,5-benzoxazepine-7-carboxylic acid 4-keto-2-methyl-3,5-dihydro-2H-1,5-benzoxazepine-7-carboxylic acid
CAS Registry Number 134076-69-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H11NO4
InChI InChI=1S/C11H11NO4/c1-6-4-10(13)12-8-5-7(11(14)15)2-3-9(8)16-6/h2-3,5-6H,4H2,1H3,(H,12,13)(H,14,15)
InChIKey UTYWAACFFFXNCC-UHFFFAOYSA-N
Molecular Weight 221.212 g/mol
SMILES N1c2cc(C(O)=O)ccc2OC(CC1=O)C
SPLASH splash10-014i-9410000000-5c3aa3e1ccd8cf4425c9
Wiley ID 1475707