For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
(S)-1-[(N-Benzyl-N-tert-butoxycarbonyl)amino]hex-2-en-4-ol
SpectraBase Compound ID 4pnLG9exabQ
InChI InChI=1S/C18H27NO3/c1-5-16(20)12-9-13-19(17(21)22-18(2,3)4)14-15-10-7-6-8-11-15/h6-12,16,20H,5,13-14H2,1-4H3/b12-9+/t16-/m0/s1
InChIKey PECYZGFDZMVQHB-YHVDPYDOSA-N
Mol Weight 305.42 g/mol
Molecular Formula C18H27NO3
Exact Mass 305.199094 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID K8LnVj0VCRp
Name (S)-1-[(N-Benzyl-N-tert-butoxycarbonyl)amino]hex-2-en-4-ol
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 305.199093730 u
Formula C18H27NO3
InChI InChI=1S/C18H27NO3/c1-5-16(20)12-9-13-19(17(21)22-18(2,3)4)14-15-10-7-6-8-11-15/h6-12,16,20H,5,13-14H2,1-4H3/b12-9+/t16-/m0/s1
InChIKey PECYZGFDZMVQHB-YHVDPYDOSA-N
Molecular Weight 305.418 g/mol
SMILES C(N(CC=1C=CC=CC1)C\C=C\[C@@](O)(CC)[H])(OC(C)(C)C)=O