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3-[[(1R,2R)-2-(benzylamino)cyclohexyl]amino]propionic acid methyl ester
SpectraBase Compound ID DuVGkD0vSns
InChI InChI=1S/C17H26N2O2/c1-21-17(20)11-12-18-15-9-5-6-10-16(15)19-13-14-7-3-2-4-8-14/h2-4,7-8,15-16,18-19H,5-6,9-13H2,1H3/t15-,16-/m1/s1
InChIKey YUNXDOUJFCSHDN-HZPDHXFCSA-N
Mol Weight 290.41 g/mol
Molecular Formula C17H26N2O2
Exact Mass 290.199428 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID QOLdDGWb46
Name 3-[[(1R,2R)-2-(benzylamino)cyclohexyl]amino]propionic acid methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H26N2O2
InChI InChI=1S/C17H26N2O2/c1-21-17(20)11-12-18-15-9-5-6-10-16(15)19-13-14-7-3-2-4-8-14/h2-4,7-8,15-16,18-19H,5-6,9-13H2,1H3/t15-,16-/m1/s1
InChIKey YUNXDOUJFCSHDN-HZPDHXFCSA-N
Molecular Weight 290.407 g/mol
SMILES N([C@]1([C@](NCc2ccccc2)(CCCC1)[H])[H])CCC(=O)OC
SPLASH splash10-0007-7920000000-1067f10d8e682434b50f
Source of Spectrum F-68-5166-2
Synonyms 3-[[(1R,2R)-2-[(phenylmethyl)amino]cyclohexyl]amino]propanoic acid methyl ester Methyl 3-[[(1R,2R)-2-[(phenylmethyl)amino]cyclohexyl]amino]propanoate
Wiley ID 1572904