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1-(2',3'-Dimethylphenyl)-1,2-dihydro-2-(chloromethyl)-3,1-benzoxazin-4-one
SpectraBase Compound ID EiOQkfB0I22
InChI InChI=1S/C17H16ClNO2/c1-11-6-5-9-14(12(11)2)19-15-8-4-3-7-13(15)17(20)21-16(19)10-18/h3-9,16H,10H2,1-2H3
InChIKey VJFHVKDMVUJQHF-UHFFFAOYSA-N
Mol Weight 301.77 g/mol
Molecular Formula C17H16ClNO2
Exact Mass 301.086956 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BWj2jIT9Tug
Name 1-(2',3'-Dimethylphenyl)-1,2-dihydro-2-(chloromethyl)-3,1-benzoxazin-4-one
Alternate Name(s) 1-(1',2'-Dimethylphenyl)-1,2-dihydro-2-(chloromethyl)-3,1-benzoxazin-4-one 2-(chloromethyl)-1-(2,3-dimethylphenyl)-1,2-dihydro-4H-3,1-benzoxazin-4-one
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Formula C17H16ClNO2
InChI InChI=1S/C17H16ClNO2/c1-11-6-5-9-14(12(11)2)19-15-8-4-3-7-13(15)17(20)21-16(19)10-18/h3-9,16H,10H2,1-2H3
InChIKey VJFHVKDMVUJQHF-UHFFFAOYSA-N
Molecular Weight 301.773 g/mol
SMILES c12N(C(OC(c2cccc1)=O)CCl)c1c(c(C)ccc1)C
SPLASH splash10-0udi-0091000000-748924204cac92b97ce8
Source of Spectrum D8-324-824-9
Wiley ID 1514222