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Methyl (1R,2R)-N-[(2-hydroxycyclohexyl)carbamoyl]acetate
SpectraBase Compound ID 1H6wjRQStbL
InChI InChI=1S/C10H17NO4/c1-15-10(14)6-9(13)11-7-4-2-3-5-8(7)12/h7-8,12H,2-6H2,1H3,(H,11,13)/t7-,8-/m1/s1
InChIKey USKIMNCMZCPIIN-HTQZYQBOSA-N
Mol Weight 215.25 g/mol
Molecular Formula C10H17NO4
Exact Mass 215.115758 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID B31hHpHfJCw
Name Methyl (1R,2R)-N-[(2-hydroxycyclohexyl)carbamoyl]acetate
Comments Computed using HOSE algorithm
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Exact Mass 215.115758027 u
Formula C10H17NO4
InChI InChI=1S/C10H17NO4/c1-15-10(14)6-9(13)11-7-4-2-3-5-8(7)12/h7-8,12H,2-6H2,1H3,(H,11,13)/t7-,8-/m1/s1
InChIKey USKIMNCMZCPIIN-HTQZYQBOSA-N
Molecular Weight 215.249 g/mol
SMILES C(N[C@]1([C@](O)(CCCC1)[H])[H])(CC(=O)OC)=O