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(R)-N-[4-[4-(Ethylheptylamino)-1-hydroxybutyl]phenyl]methanesulfonamide (E)-2-butenedioate
SpectraBase Compound ID Bo34hmWkVh1
InChI InChI=1S/C20H36N2O3S/c1-4-6-7-8-9-16-22(5-2)17-10-11-20(23)18-12-14-19(15-13-18)21-26(3,24)25/h12-15,20-21,23H,4-11,16-17H2,1-3H3/t20-/m1/s1
InChIKey ALOBUEHUHMBRLE-HXUWFJFHSA-N
Mol Weight 384.6 g/mol
Molecular Formula C20H36N2O3S
Exact Mass 384.244664 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CBNJK9tJZda
Name (R)-N-[4-[4-(Ethylheptylamino)-1-hydroxybutyl]phenyl]methanesulfonamide (E)-2-butenedioate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H36N2O3S
InChI InChI=1S/C20H36N2O3S/c1-4-6-7-8-9-16-22(5-2)17-10-11-20(23)18-12-14-19(15-13-18)21-26(3,24)25/h12-15,20-21,23H,4-11,16-17H2,1-3H3/t20-/m1/s1
InChIKey ALOBUEHUHMBRLE-HXUWFJFHSA-N
Molecular Weight 384.579 g/mol
SMILES N(S(=O)(=O)C)c1ccc([C@](O)(CCCN(CC)CCCCCCC)[H])cc1
SPLASH splash10-0a4i-0944000000-a5bb581d83bc81ac553e
Source of Spectrum QC-7-686-15
Synonyms N-[4-[(1R)-4-[ethyl(heptyl)amino]-1-hydroxybutyl]phenyl]methanesulfonamide N-[4-[(1R)-4-[ethyl(heptyl)amino]-1-oxidanyl-butyl]phenyl]methanesulfonamide
Wiley ID 869206