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Benzamide, N-[2-hydroxy-6-[(methylsulfonyl)oxy]phenyl]-4-octyl-
SpectraBase Compound ID JbF5DO0vyGR
InChI InChI=1S/C22H29NO5S/c1-3-4-5-6-7-8-10-17-13-15-18(16-14-17)22(25)23-21-19(24)11-9-12-20(21)28-29(2,26)27/h9,11-16,24H,3-8,10H2,1-2H3,(H,23,25)
InChIKey BKVZGWOWNYRJTO-UHFFFAOYSA-N
Mol Weight 419.54 g/mol
Molecular Formula C22H29NO5S
Exact Mass 419.176644 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3f6z8l7AsBx
Name Benzamide, N-[2-hydroxy-6-[(methylsulfonyl)oxy]phenyl]-4-octyl-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H29NO5S
InChI InChI=1S/C22H29NO5S/c1-3-4-5-6-7-8-10-17-13-15-18(16-14-17)22(25)23-21-19(24)11-9-12-20(21)28-29(2,26)27/h9,11-16,24H,3-8,10H2,1-2H3,(H,23,25)
InChIKey BKVZGWOWNYRJTO-UHFFFAOYSA-N
Molecular Weight 419.536 g/mol
SMILES N(C(c1ccc(CCCCCCCC)cc1)=O)c1c(cccc1OS(C)(=O)=O)O
SPLASH splash10-014i-6190000000-1414a8b7fde7caa2cb96
Source of Spectrum JX-2015-4-257
Synonyms 3-Hydroxy-2-(4-octylbenzamido)phenyl methanesulfonate 3-Hydroxy-2-[(4-octylbenzoyl)amino]phenyl methanesulfonate Methanesulfonic acid [3-hydroxy-2-[[(4-octylphenyl)-oxomethyl]amino]phenyl] ester [3-hydroxy-2-[(4-octylbenzoyl)amino]phenyl] methanesulfonate [2-[(4-octylphenyl)carbonylamino]-3-oxidanyl-phenyl] methanesulfonate
Wiley ID 1725705