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(1S,3S,4R)-3-Menthyl 2-methoxycarbonylamino-2-phenylacetate

View entire compound with spectra: 1 NMR, and 1 MS (GC)

(1S,3S,4R)-3-Menthyl 2-methoxycarbonylamino-2-phenylacetate
SpectraBase Compound ID IWTxvbDTpV7
InChI InChI=1S/C20H29NO4/c1-13(2)16-11-10-14(3)12-17(16)25-19(22)18(21-20(23)24-4)15-8-6-5-7-9-15/h5-9,13-14,16-18H,10-12H2,1-4H3,(H,21,23)/t14-,16+,17-,18?/m0/s1
InChIKey NQYOQWJDEJKFHC-VVHKBJRUSA-N
Mol Weight 347.46 g/mol
Molecular Formula C20H29NO4
Exact Mass 347.209658 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID C03vXgPhJ5m
Name (1S,3S,4R)-3-Menthyl 2-methoxycarbonylamino-2-phenylacetate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 347.209658414 u
Formula C20H29NO4
InChI InChI=1S/C20H29NO4/c1-13(2)16-11-10-14(3)12-17(16)25-19(22)18(21-20(23)24-4)15-8-6-5-7-9-15/h5-9,13-14,16-18H,10-12H2,1-4H3,(H,21,23)/t14-,16+,17-,18?/m0/s1
InChIKey NQYOQWJDEJKFHC-VVHKBJRUSA-N
Molecular Weight 347.455 g/mol
SMILES C(O[C@@]1([C@](CC[C@@](C1)(C)[H])(C(C)C)[H])[H])(C(NC(=O)OC)C=1C=CC=CC1)=O