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Butanoic acid, 4-[[(5-fluoro-2-methoxyphenyl)sulfonyl]methylamino]-
SpectraBase Compound ID 5z8a2U8jkKQ
InChI InChI=1S/C12H16FNO5S/c1-14(7-3-4-12(15)16)20(17,18)11-8-9(13)5-6-10(11)19-2/h5-6,8H,3-4,7H2,1-2H3,(H,15,16)
InChIKey OBPDOUPTGXRCHI-UHFFFAOYSA-N
Mol Weight 305.32 g/mol
Molecular Formula C12H16FNO5S
Exact Mass 305.073322 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DbHKFDflpaG
Name Butanoic acid, 4-[[(5-fluoro-2-methoxyphenyl)sulfonyl]methylamino]-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H16FNO5S
InChI InChI=1S/C12H16FNO5S/c1-14(7-3-4-12(15)16)20(17,18)11-8-9(13)5-6-10(11)19-2/h5-6,8H,3-4,7H2,1-2H3,(H,15,16)
InChIKey OBPDOUPTGXRCHI-UHFFFAOYSA-N
Molecular Weight 305.320 g/mol
SMILES OC(CCCN(S(c1cc(ccc1OC)F)(=O)=O)C)=O
SPLASH splash10-0006-9400000000-2b74fd38a4ec78562d12
Source of Spectrum IY-1-4641-0
Synonyms 4-[(5-fluoro-2-methoxyphenyl)sulfonyl-methylamino]butanoic acid 4-[(5-fluoro-2-methoxy-phenyl)sulfonyl-methyl-amino]butanoic acid 4-[(5-fluoranyl-2-methoxy-phenyl)sulfonyl-methyl-amino]butanoic acid
Wiley ID 1654393