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N-carbobenzyloxyl-leucine, 1TMS
SpectraBase Compound ID 7l635i8zcc
InChI InChI=1S/C17H27NO4Si/c1-13(2)11-15(16(19)22-23(3,4)5)18-17(20)21-12-14-9-7-6-8-10-14/h6-10,13,15H,11-12H2,1-5H3,(H,18,20)/t15-/m0/s1
InChIKey NRZBAYXDOYVHDR-HNNXBMFYSA-N
Mol Weight 337.49 g/mol
Molecular Formula C17H27NO4Si
Exact Mass 337.170935 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3SXXTNEL2HZ
Name N-carbobenzyloxyl-leucine, 1TMS
Comments Derivatization type: 1 TMS (mass: 337.171); CC-BY: Oliver Fiehn, University of California, Davis; MoNA-ID: FiehnLib001005; Note: The molecular formula of the structure shown is C14H19NO4 - which differs from the formula reported for the mass spectrum (C17H27NO4Si)
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Formula C17H27NO4Si
InChI InChI=1S/C17H27NO4Si/c1-13(2)11-15(16(19)22-23(3,4)5)18-17(20)21-12-14-9-7-6-8-10-14/h6-10,13,15H,11-12H2,1-5H3,(H,18,20)/t15-/m0/s1
InChIKey NRZBAYXDOYVHDR-HNNXBMFYSA-N
Molecular Weight 337.491 g/mol
SMILES N([C@@](CC(C)C)(C(=O)O[Si](C)(C)C)[H])C(=O)OCc1ccccc1
SPLASH splash10-0006-9200000000-a2513157420de09b51b6
Source of Spectrum FM-2019-1005-0
Synonyms Carbobenzoxyleucine, 1TMS N-Cbz-L-leucine, 1TMS Z-L-Leucine, 1TMS Carbobenzoxy-L-leucine, 1TMS Carbobenzyloxy-L-leucine, 1TMS Z-Leu-OH, 1TMS N-Carbobenzyloxy-L-leucine, 1TMS (2S)-4-methyl-2-(phenylmethoxycarbonylamino)pentanoic acid, 1TMS Trimethylsilyl ((benzyloxy)carbonyl)-L-leucinate
Wiley ID 1818664