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6-aminohexanoic acid, hexyl ester, p-toluenesulfonate(1:1)(salt)

View entire compound with spectra: 2 NMR, and 1 UV-Vis

6-aminohexanoic acid, hexyl ester, p-toluenesulfonate(1:1)(salt)
SpectraBase Compound ID wt5vpTB4Vt
InChI InChI=1S/C12H25NO2.C7H8O3S/c1-2-3-4-8-11-15-12(14)9-6-5-7-10-13;1-6-2-4-7(5-3-6)11(8,9)10/h2-11,13H2,1H3;2-5H,1H3,(H,8,9,10)
InChIKey RVALTWBPTNLNAV-UHFFFAOYSA-N
Mol Weight 387.53 g/mol
Molecular Formula C19H33NO5S
Exact Mass 387.207944 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 70KyZnv8mXc
Name 6-AMINOHEXANOIC ACID, HEXYL ESTER, p-TOLUENESULFONATE (1:1) (SALT)
Source of Sample Tokyo Kasei Kogyo Company, Ltd., Tokyo, Japan
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H25NO2 C7H8O3S
InChI InChI=1S/C12H25NO2.C7H8O3S/c1-2-3-4-8-11-15-12(14)9-6-5-7-10-13;1-6-2-4-7(5-3-6)11(8,9)10/h2-11,13H2,1H3;2-5H,1H3,(H,8,9,10)
InChIKey RVALTWBPTNLNAV-UHFFFAOYSA-N
Melting Point 97C
Molecular Weight 387.54
Solvent Polysol; Reference=TMS Spectrometer= Varian CFT-20
Synonyms HEXANOIC ACID, 6-AMINO-, HEXYL ESTER, P-TOLUENESULFONATE /1 TO 1/ /SALT/