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(2R)-2-[[(2S)-2-(methoxymethyl)-1-pyrrolidinyl]amino]-1-butanesulfonic acid
SpectraBase Compound ID 2FNGuf95NJw
InChI InChI=1S/C16H32N2O4S/c1-3-14(17-18-11-7-8-15(18)12-21-2)13-23(19,20)22-16-9-5-4-6-10-16/h14-17H,3-13H2,1-2H3/t14-,15+/m1/s1
InChIKey LIDNXUMABVARMA-CABCVRRESA-N
Mol Weight 348.5 g/mol
Molecular Formula C16H32N2O4S
Exact Mass 348.208279 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LmmrWggQOAE
Name (2R)-2-[[(2S)-2-(methoxymethyl)-1-pyrrolidinyl]amino]-1-butanesulfonic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H32N2O4S
InChI InChI=1S/C16H32N2O4S/c1-3-14(17-18-11-7-8-15(18)12-21-2)13-23(19,20)22-16-9-5-4-6-10-16/h14-17H,3-13H2,1-2H3/t14-,15+/m1/s1
InChIKey LIDNXUMABVARMA-CABCVRRESA-N
Molecular Weight 348.502 g/mol
SMILES N(N1[C@](COC)(CCC1)[H])[C@@](CS(OC1CCCCC1)(=O)=O)(CC)[H]
SPLASH splash10-00di-1090000000-5d963af2b6237e684fbf
Source of Spectrum C5-2003-1860-4
Synonyms (2R)-2-[[(2S)-2-(methoxymethyl)pyrrolidino]amino]butane-1-sulfonic acid cyclohexyl ester cyclohexyl (2R)-2-[[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]amino]butane-1-sulfonate
Wiley ID 1615774