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(1R,2R)-2-[2'-Hydroxy-1'(S)-tert-butylethylcarbamoyl]cyclopentane-1-carboxylic acid
SpectraBase Compound ID KgnESmNI83u
InChI InChI=1S/C13H23NO4/c1-13(2,3)10(7-15)14-11(16)8-5-4-6-9(8)12(17)18/h8-10,15H,4-7H2,1-3H3,(H,14,16)(H,17,18)/t8-,9-,10-/m1/s1
InChIKey XDSOKACLCRHOCP-OPRDCNLKSA-N
Mol Weight 257.33 g/mol
Molecular Formula C13H23NO4
Exact Mass 257.162708 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3R6rTBSigMv
Name (1R,2R)-2-[2'-Hydroxy-1'(S)-tert-butylethylcarbamoyl]cyclopentane-1-carboxylic acid
Alternate Name(s) (1R,2R)-2-({[(1S)-1-(hydroxymethyl)-2,2-dimethylpropyl]amino}carbonyl)cyclopentanecarboxylic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H23NO4
InChI InChI=1S/C13H23NO4/c1-13(2,3)10(7-15)14-11(16)8-5-4-6-9(8)12(17)18/h8-10,15H,4-7H2,1-3H3,(H,14,16)(H,17,18)/t8-,9-,10-/m1/s1
InChIKey XDSOKACLCRHOCP-OPRDCNLKSA-N
Molecular Weight 257.330 g/mol
SMILES N(C([C@]1([C@](C(=O)O)(CCC1)[H])[H])=O)[C@](CO)(C(C)(C)C)[H]
SPLASH splash10-01ti-9170000000-e29a2106e768de44926f
Source of Spectrum QC-17-628-31
Wiley ID 1638069