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5-Chloranyl-2-(9H-xanthen-9-yl)isoindole-1,3-dione
SpectraBase Compound ID 3AcqVeSxyyy
InChI InChI=1S/C21H12ClNO3/c22-12-9-10-13-16(11-12)21(25)23(20(13)24)19-14-5-1-3-7-17(14)26-18-8-4-2-6-15(18)19/h1-11,19H
InChIKey LFUSQLIFHQNTHF-UHFFFAOYSA-N
Mol Weight 361.78 g/mol
Molecular Formula C21H12ClNO3
Exact Mass 361.050571 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6Dz82YoALb0
Name 5-Chloranyl-2-(9H-xanthen-9-yl)isoindole-1,3-dione
Alternate Name(s) 5-Chloro-2-(9H-xanthen-9-yl)isoindole-1,3-dione 5-Chloro-2-(9H-xanthen-9-yl)isoindoline-1,3-dione 5-Chloro-2-(9H-xanthen-9-yl)isoindoline-1,3-quinone
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Formula C21H12ClNO3
InChI InChI=1S/C21H12ClNO3/c22-12-9-10-13-16(11-12)21(25)23(20(13)24)19-14-5-1-3-7-17(14)26-18-8-4-2-6-15(18)19/h1-11,19H
InChIKey LFUSQLIFHQNTHF-UHFFFAOYSA-N
Molecular Weight 361.784 g/mol
SMILES C1(c2c(cccc2)Oc2c1cccc2)N1C(c2ccc(cc2C1=O)Cl)=O
SPLASH splash10-001i-2901000000-dd4b836347e9fb3cb509
Wiley ID 1452534