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10-chloranyl-8-methyl-6a-(trichloromethyl)-12H-[1,3]benzoxazino[3,2-a][3,1]benzoxazin-5-one
SpectraBase Compound ID 7vNtDmOYeh2
InChI InChI=1S/C17H11Cl4NO3/c1-9-6-11(18)7-10-8-22-13-5-3-2-4-12(13)15(23)25-17(22,16(19,20)21)24-14(9)10/h2-7H,8H2,1H3
InChIKey UFYYWLNAWBJDOD-UHFFFAOYSA-N
Mol Weight 419.1 g/mol
Molecular Formula C17H11Cl4NO3
Exact Mass 416.949304 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID iqBOP9J32B
Name 10-chloranyl-8-methyl-6a-(trichloromethyl)-12H-[1,3]benzoxazino[3,2-a][3,1]benzoxazin-5-one
CAS Registry Number 126839-91-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H11Cl4NO3
InChI InChI=1S/C17H11Cl4NO3/c1-9-6-11(18)7-10-8-22-13-5-3-2-4-12(13)15(23)25-17(22,16(19,20)21)24-14(9)10/h2-7H,8H2,1H3
InChIKey UFYYWLNAWBJDOD-UHFFFAOYSA-N
Molecular Weight 419.091 g/mol
SMILES C12(N(c3ccccc3C(O2)=O)Cc2c(O1)c(cc(Cl)c2)C)C(Cl)(Cl)Cl
SPLASH splash10-0udi-0819000000-8efdf094e3dab715ee69
Source of Spectrum Y-26-1387-17
Synonyms 10-chloro-8-methyl-6a-(trichloromethyl)-12H-[1,3]benzoxazino[3,2-a][3,1]benzoxazin-5-one
Wiley ID 1376758