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nitric acid 2-(4-keto-7-methyl-2H-1,3-benzoxazin-3-yl)ethyl ester
SpectraBase Compound ID DSwdFHTVWup
InChI InChI=1S/C11H12N2O5/c1-8-2-3-9-10(6-8)17-7-12(11(9)14)4-5-18-13(15)16/h2-3,6H,4-5,7H2,1H3
InChIKey JCKFVYYCSDOULV-UHFFFAOYSA-N
Mol Weight 252.23 g/mol
Molecular Formula C11H12N2O5
Exact Mass 252.074621 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ce6gNGDbN6
Name 2-(7-Methyl-4-oxidanylidene-2H-1,3-benzoxazin-3-yl)ethyl nitrate
CAS Registry Number 143248-66-2
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Formula C11H12N2O5
InChI InChI=1S/C11H12N2O5/c1-8-2-3-9-10(6-8)17-7-12(11(9)14)4-5-18-13(15)16/h2-3,6H,4-5,7H2,1H3
InChIKey JCKFVYYCSDOULV-UHFFFAOYSA-N
Molecular Weight 252.226 g/mol
SMILES C1(c2c(cc(cc2)C)OCN1CCON(=O)=O)=O
SPLASH splash10-003r-2910000000-2e5ce549d929f9d3a954
Source of Spectrum O-29-533-0
Synonyms 2-(7-Methyl-4-oxo-2H-1,3-benzoxazin-3(4H)-yl)ethyl nitrate 2-(7-Methyl-4-oxo-2H-1,3-benzoxazin-3-yl)ethyl nitrate Nitric acid 2-(4-keto-7-methyl-2H-1,3-benzoxazin-3-yl)ethyl ester Nitric acid 2-(7-methyl-4-oxo-2H-1,3-benzoxazin-3-yl)ethyl ester
Wiley ID 1255108