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2H-1,4-Benzoxazine-2-acetic acid, 3,4-dihydro-3-oxo-, propyl ester
SpectraBase Compound ID IPeLKLF9tpC
InChI InChI=1S/C13H15NO4/c1-2-7-17-12(15)8-11-13(16)14-9-5-3-4-6-10(9)18-11/h3-6,11H,2,7-8H2,1H3,(H,14,16)
InChIKey QGLNUYNXHCOIOK-UHFFFAOYSA-N
Mol Weight 249.27 g/mol
Molecular Formula C13H15NO4
Exact Mass 249.100108 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GPBNxCoSLAH
Name 2H-1,4-Benzoxazine-2-acetic acid, 3,4-dihydro-3-oxo-, propyl ester
Alternate Name(s) Propyl (3'-oxo-3',4'-dihydro-2'h-1',4'-benzoxazin-2'yl)acetate Propyl (3-oxo-3,4-dihydro-2H-1,4-benzoxazin-2-yl)acetate
CAS Registry Number 106660-12-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H15NO4
InChI InChI=1S/C13H15NO4/c1-2-7-17-12(15)8-11-13(16)14-9-5-3-4-6-10(9)18-11/h3-6,11H,2,7-8H2,1H3,(H,14,16)
InChIKey QGLNUYNXHCOIOK-UHFFFAOYSA-N
Molecular Weight 249.266 g/mol
SMILES N1c2c(OC(C1=O)CC(=O)OCCC)cccc2
SPLASH splash10-03dj-0920000000-cef2e0a6de2286c328ce
Source of Spectrum B-39-509-2
Wiley ID 1252120