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L-Methionine, N-benzyloxycarbonyl-, nonyl ester

View entire compound with spectra: 1 NMR

L-Methionine, N-benzyloxycarbonyl-, nonyl ester
SpectraBase Compound ID 7Ki8gmPaiNE
InChI InChI=1S/C22H35NO4S/c1-3-4-5-6-7-8-12-16-26-21(24)20(15-17-28-2)23-22(25)27-18-19-13-10-9-11-14-19/h9-11,13-14,20H,3-8,12,15-18H2,1-2H3,(H,23,25)
InChIKey KFEHSLNLRXVPIW-UHFFFAOYSA-N
Mol Weight 409.6 g/mol
Molecular Formula C22H35NO4S
Exact Mass 409.22868 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 60mAEapvu4A
Name L-Methionine, N-benzyloxycarbonyl-, nonyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 409.228679781 u
Formula C22H35NO4S
InChI InChI=1S/C22H35NO4S/c1-3-4-5-6-7-8-12-16-26-21(24)20(15-17-28-2)23-22(25)27-18-19-13-10-9-11-14-19/h9-11,13-14,20H,3-8,12,15-18H2,1-2H3,(H,23,25)
InChIKey KFEHSLNLRXVPIW-UHFFFAOYSA-N
Molecular Weight 409.585 g/mol
SMILES C1=CC=CC=C1COC(NC(C(OCCCCCCCCC)=O)CCSC)=O