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4,5,6,7-tetrabromo-2-(methylsulfonyl)-2,3-dihydro-1H-isoindole
SpectraBase Compound ID JkSmqGUiQU9
InChI InChI=1S/C9H7Br4NO2S/c1-17(15,16)14-2-4-5(3-14)7(11)9(13)8(12)6(4)10/h2-3H2,1H3
InChIKey MUHHVMRILIYRSF-UHFFFAOYSA-N
Mol Weight 512.84 g/mol
Molecular Formula C9H7Br4NO2S
Exact Mass 508.693102 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3aID0hF3f75
Name 4,5,6,7-tetrabromo-2-(methylsulfonyl)-2,3-dihydro-1H-isoindole
CAS Registry Number 52964-31-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H7Br4NO2S
InChI InChI=1S/C9H7Br4NO2S/c1-17(15,16)14-2-4-5(3-14)7(11)9(13)8(12)6(4)10/h2-3H2,1H3
InChIKey MUHHVMRILIYRSF-UHFFFAOYSA-N
Molecular Weight 512.836 g/mol
SMILES c12c(c(Br)c(c(c2Br)Br)Br)CN(S(=O)(=O)C)C1
SPLASH splash10-001i-5322900000-0e7ded9fb4ef5db56e66
Source of Spectrum K-121-1830-3
Synonyms 4,5,6,7-tetrabromo-2-(methylsulfonyl)isoindoline
Wiley ID 1400306