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Methyl (2S)-2-{-tert-butoxy)-N-[(tert-butyloxy)carbonyl]carbonylamino}icosanoate
SpectraBase Compound ID 5CC1JrTsSBE
InChI InChI=1S/C31H59NO6/c1-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26(27(33)36-8)32(28(34)37-30(2,3)4)29(35)38-31(5,6)7/h26H,9-25H2,1-8H3/t26-/m0/s1
InChIKey KLQKYEQHGUBSJL-SANMLTNESA-N
Mol Weight 541.8 g/mol
Molecular Formula C31H59NO6
Exact Mass 541.434239 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KoxVFnMoOOi
Name Methyl (2S)-2-{-tert-butoxy)-N-[(tert-butyloxy)carbonyl]carbonylamino}icosanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C31H59NO6
InChI InChI=1S/C31H59NO6/c1-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26(27(33)36-8)32(28(34)37-30(2,3)4)29(35)38-31(5,6)7/h26H,9-25H2,1-8H3/t26-/m0/s1
InChIKey KLQKYEQHGUBSJL-SANMLTNESA-N
Molecular Weight 541.814 g/mol
SMILES C(N(C(OC(C)(C)C)=O)[C@](C(=O)OC)(CCCCCCCCCCCCCCCCCC)[H])(OC(C)(C)C)=O
SPLASH splash10-0a4i-9024000000-ed578ab87c684352d8f0
Source of Spectrum QC-9-3387-17
Wiley ID 870795