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N-acetyl-beta-alanine, 2TMS
SpectraBase Compound ID BCSQiEBJzu
InChI InChI=1S/C11H25NO3Si2/c1-10(13)12(16(2,3)4)9-8-11(14)15-17(5,6)7/h8-9H2,1-7H3
InChIKey QFQDOCUHCZBFMF-UHFFFAOYSA-N
Mol Weight 275.5 g/mol
Molecular Formula C11H25NO3Si2
Exact Mass 275.137297 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GPwFRGr6Xdl
Name N-acetyl-beta-alanine, 2TMS
Comments Derivatization type: 2 TMS (mass: 275.137); CC-BY: Oliver Fiehn, University of California, Davis; MoNA-ID: FiehnLib000681; Note: The molecular formula of the structure shown is C5H9NO3 - which differs from the formula reported for the mass spectrum (C11H25NO3Si2)
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H25NO3Si2
InChI InChI=1S/C11H25NO3Si2/c1-10(13)12(16(2,3)4)9-8-11(14)15-17(5,6)7/h8-9H2,1-7H3
InChIKey QFQDOCUHCZBFMF-UHFFFAOYSA-N
Molecular Weight 275.495 g/mol
SMILES CC(N(CCC(=O)O[Si](C)(C)C)[Si](C)(C)C)=O
SPLASH splash10-0a4i-0900000000-a6ba43eb65e6125f4c78
Source of Spectrum FM-2019-681-0
Synonyms N-Acetyl-beta-alanine, 2TMS 3-Acetamidopropanoic acid, 2TMS 3-(acetylamino)propanoic acid, 2TMS CHEBI:16682, 2TMS NSC32039, 2TMS EINECS 221-185-6, 2TMS 3-Acetamidopropanoic acid, 2TMS Trimethylsilyl 3-(N-(trimethylsilyl)acetamido)propanoate
Wiley ID 1818359