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L-Norvaline, N-neopentyloxycarbonyl-, octadecyl ester
SpectraBase Compound ID 7rt0uWBPMNm
InChI InChI=1S/C29H57NO4/c1-6-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-24-33-27(31)26(23-7-2)30-28(32)34-25-29(3,4)5/h26H,6-25H2,1-5H3,(H,30,32)
InChIKey ZGSJVSFXCIFFMA-UHFFFAOYSA-N
Mol Weight 483.8 g/mol
Molecular Formula C29H57NO4
Exact Mass 483.428759 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3yfKhUFjm2j
Name L-Norvaline, N-neopentyloxycarbonyl-, octadecyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 483.428759315 u
Formula C29H57NO4
InChI InChI=1S/C29H57NO4/c1-6-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-24-33-27(31)26(23-7-2)30-28(32)34-25-29(3,4)5/h26H,6-25H2,1-5H3,(H,30,32)
InChIKey ZGSJVSFXCIFFMA-UHFFFAOYSA-N
Molecular Weight 483.778 g/mol
SMILES CC(COC(NC(C(OCCCCCCCCCCCCCCCCCC)=O)CCC)=O)(C)C