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3-[2-[bis(bromanyl)methyl]phenyl]-4-bromanyl-2-methyl-isoquinolin-1-one
SpectraBase Compound ID 2STKbvLSDFn
InChI InChI=1S/C17H12Br3NO/c1-21-15(11-7-3-4-8-12(11)16(19)20)14(18)10-6-2-5-9-13(10)17(21)22/h2-9,16H,1H3
InChIKey ZBYKTXSRZQQWDH-UHFFFAOYSA-N
Mol Weight 486.0 g/mol
Molecular Formula C17H12Br3NO
Exact Mass 482.846903 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5JLoWt6Rd9u
Name 3-[2-[bis(bromanyl)methyl]phenyl]-4-bromanyl-2-methyl-isoquinolin-1-one
Comments Less than 3 mono-isotopic peaks
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Formula C17H12Br3NO
InChI InChI=1S/C17H12Br3NO/c1-21-15(11-7-3-4-8-12(11)16(19)20)14(18)10-6-2-5-9-13(10)17(21)22/h2-9,16H,1H3
InChIKey ZBYKTXSRZQQWDH-UHFFFAOYSA-N
Molecular Weight 486.001 g/mol
SMILES C1(N(C(=C(c2ccccc12)Br)c1c(cccc1)C(Br)Br)C)=O
SPLASH splash10-052r-0000900000-96e74e3ca216e298e03c
Source of Spectrum E2-47-901-8
Synonyms 4-bromo-3-[2-(dibromomethyl)phenyl]-2-methyl-1-isoquinolinone 4-bromo-3-[2-(dibromomethyl)phenyl]-2-methyl-isocarbostyril 4-bromo-3-[2-(dibromomethyl)phenyl]-2-methyl-isoquinolin-1-one
Wiley ID 1554958