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2H-1,4-Benzoxazin-3(4H)-one, 6-[[6-bromo-3,4-dihydro-1(2H)-quinolinyl]sulfonyl]-7-methyl-
SpectraBase Compound ID 7JYwInAgSps
InChI InChI=1S/C18H17BrN2O4S/c1-11-7-16-14(20-18(22)10-25-16)9-17(11)26(23,24)21-6-2-3-12-8-13(19)4-5-15(12)21/h4-5,7-9H,2-3,6,10H2,1H3,(H,20,22)
InChIKey ZXUWBKGTBPRLBG-UHFFFAOYSA-N
Mol Weight 437.31 g/mol
Molecular Formula C18H17BrN2O4S
Exact Mass 436.009241 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4wDZcff2lkH
Name 2H-1,4-Benzoxazin-3(4H)-one, 6-[[6-bromo-3,4-dihydro-1(2H)-quinolinyl]sulfonyl]-7-methyl-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H17BrN2O4S
InChI InChI=1S/C18H17BrN2O4S/c1-11-7-16-14(20-18(22)10-25-16)9-17(11)26(23,24)21-6-2-3-12-8-13(19)4-5-15(12)21/h4-5,7-9H,2-3,6,10H2,1H3,(H,20,22)
InChIKey ZXUWBKGTBPRLBG-UHFFFAOYSA-N
Molecular Weight 437.308 g/mol
SMILES N1C(COc2cc(c(cc12)S(N1c2c(cc(cc2)Br)CCC1)(=O)=O)C)=O
SPLASH splash10-01q9-3950100000-523bc0ba2a677514b50d
Source of Spectrum IY-2-5018-3
Synonyms 6-(6-bromo-1,2,3,4-tetrahydroquinoline-1-sulfonyl)-7-methyl-3,4-dihydro-2H-1,4-benzoxazin-3-one 6-[(6-bromanyl-3,4-dihydro-2H-quinolin-1-yl)sulfonyl]-7-methyl-4H-1,4-benzoxazin-3-one
Wiley ID 1658166