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(phenylmethyl) N-[(2S)-1-azanyl-3-methyl-1-oxidanylidene-butan-2-yl]carbamate

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

(phenylmethyl) N-[(2S)-1-azanyl-3-methyl-1-oxidanylidene-butan-2-yl]carbamate
SpectraBase Compound ID 2CAHkWJlsVZ
InChI InChI=1S/C13H18N2O3/c1-9(2)11(12(14)16)15-13(17)18-8-10-6-4-3-5-7-10/h3-7,9,11H,8H2,1-2H3,(H2,14,16)(H,15,17)/t11-/m0/s1
InChIKey LWAHIZLDUQONHV-NSHDSACASA-N
Mol Weight 250.3 g/mol
Molecular Formula C13H18N2O3
Exact Mass 250.131742 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID vTNiPusIn0
Name (Phenylmethyl) N-[(2S)-1-azanyl-3-methyl-1-oxidanylidene-butan-2-yl]carbamate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 250.131742445 u
Formula C13H18N2O3
InChI InChI=1S/C13H18N2O3/c1-9(2)11(12(14)16)15-13(17)18-8-10-6-4-3-5-7-10/h3-7,9,11H,8H2,1-2H3,(H2,14,16)(H,15,17)/t11-/m0/s1
InChIKey LWAHIZLDUQONHV-NSHDSACASA-N
Molecular Weight 250.298 g/mol
SMILES C(N[C@](C(=O)N)(C(C)C)[H])(=O)OCC1=CC=CC=C1