For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
3-keto-4-methyl-1,4-benzoxazine-2-carboxylic acid ethyl ester
SpectraBase Compound ID 1BSuSLbmkgT
InChI InChI=1S/C12H13NO4/c1-3-16-12(15)10-11(14)13(2)8-6-4-5-7-9(8)17-10/h4-7,10H,3H2,1-2H3
InChIKey HTHWMMMCFQDZCT-UHFFFAOYSA-N
Mol Weight 235.24 g/mol
Molecular Formula C12H13NO4
Exact Mass 235.084458 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 4SMlQqXKpgb
Name 3-keto-4-methyl-1,4-benzoxazine-2-carboxylic acid ethyl ester
Alternate Name(s) 4-Methyl-3-oxo-1,4-benzoxazine-2-carboxylic acid ethyl ester Ethyl 4-methyl-3-oxidanylidene-1,4-benzoxazine-2-carboxylate Ethyl 4-methyl-3-oxo-1,4-benzoxazine-2-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H13NO4
InChI InChI=1S/C12H13NO4/c1-3-16-12(15)10-11(14)13(2)8-6-4-5-7-9(8)17-10/h4-7,10H,3H2,1-2H3
InChIKey HTHWMMMCFQDZCT-UHFFFAOYSA-N
Molecular Weight 235.239 g/mol
SMILES C1(C(Oc2c(N1C)cccc2)C(=O)OCC)=O
SPLASH splash10-01q0-2950000000-1f246baf7e0444f11072
Source of Spectrum SK-28-2743-2
Wiley ID 868502