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Aspartam-A (-H2O) TMS
SpectraBase Compound ID I1ujfl26scP
InChI InChI=1S/C17H24N2O4Si/c1-23-17(22)14(10-12-8-6-5-7-9-12)19(24(2,3)4)16(21)13-11-15(20)18-13/h5-9,13-14H,10-11H2,1-4H3,(H,18,20)/t13-,14?/m0/s1
InChIKey MNBBUXOUNRKQQP-LSLKUGRBSA-N
Mol Weight 348.47 g/mol
Molecular Formula C17H24N2O4Si
Exact Mass 348.150534 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JGAZjqhT4eu
Name Aspartam-A (-H2O) TMS
Classification Sweetener artifact derivative
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 348.150533792 u
Formula C17H24N2O4Si
InChI InChI=1S/C17H24N2O4Si/c1-23-17(22)14(10-12-8-6-5-7-9-12)19(24(2,3)4)16(21)13-11-15(20)18-13/h5-9,13-14H,10-11H2,1-4H3,(H,18,20)/t13-,14?/m0/s1
InChIKey MNBBUXOUNRKQQP-LSLKUGRBSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 348.474 g/mol
Nominal Mass 348 u
Quality 989
Retention Index 2666
SMILES C(N(C([C@]1(NC(C1)=O)[H])=O)[Si](C)(C)C)(CC=1C=CC=CC1)C(OC)=O
SPLASH splash10-001i-4925000000-b83b03dea566b2c812a6
Sample Comments Structure uncertain
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms methyl (2S)-2-((((2S)-4-oxoazetidin-2-yl)carbonyl)(trimethylsilyl)amino)-3-phenylpropanoate
Technique GC/MS
Wiley ID DD2024_014475