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N-acetyl-leucine, 1TMS
SpectraBase Compound ID HFkhhKgIvV2
InChI InChI=1S/C11H23NO3Si/c1-8(2)7-10(12-9(3)13)11(14)15-16(4,5)6/h8,10H,7H2,1-6H3,(H,12,13)/t10-/m0/s1
InChIKey XQDFESPJHFMWMH-JTQLQIEISA-N
Mol Weight 245.39 g/mol
Molecular Formula C11H23NO3Si
Exact Mass 245.14472 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9ncpYqsTlRI
Name N-acetyl-leucine, 1TMS
Comments Derivatization type: 1 TMS (mass: 245.145); CC-BY: Oliver Fiehn, University of California, Davis; MoNA-ID: FiehnLib000006; Note: The molecular formula of the structure shown is C8H15NO3 - which differs from the formula reported for the mass spectrum (C11H23NO3Si)
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H23NO3Si
InChI InChI=1S/C11H23NO3Si/c1-8(2)7-10(12-9(3)13)11(14)15-16(4,5)6/h8,10H,7H2,1-6H3,(H,12,13)/t10-/m0/s1
InChIKey XQDFESPJHFMWMH-JTQLQIEISA-N
Molecular Weight 245.394 g/mol
SMILES N(C(C)=O)[C@@](CC(C)C)(C(=O)O[Si](C)(C)C)[H]
SPLASH splash10-000i-7900000000-4c3753a7ea07ce2fe178
Source of Spectrum FM-2019-6-0
Synonyms Acetylleucine, 1TMS N-Acetylleucine, 1TMS N-Acetyl-L-leucine, 1TMS Acetyl-L-leucine, 1TMS N-acetyl-Leu, 1TMS (2S)-2-acetamido-4-methylpentanoic acid, 1TMS Trimethylsilyl acetyl-L-leucinate
Wiley ID 1817708