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2-Amino-3-(3,4-dihydroxyphenyl)propanoic acid 3TMS
SpectraBase Compound ID 5c6WOdSu8Yw
InChI InChI=1S/C18H35NO4Si3/c1-24(2,3)19(25(4,5)6)15(18(22)23-26(7,8)9)12-14-10-11-16(20)17(21)13-14/h10-11,13,15,20-21H,12H2,1-9H3
InChIKey SMRZIPCULYTDHM-UHFFFAOYSA-N
Mol Weight 413.7 g/mol
Molecular Formula C18H35NO4Si3
Exact Mass 413.187388 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JFdyRGwl7nU
Name 2-Amino-3-(3,4-dihydroxyphenyl)propanoic acid 3TMS
CAS Registry Number 68595-53-9
Classification Chemical
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 413.187388212 u
Formula C18H35NO4Si3
InChI InChI=1S/C18H35NO4Si3/c1-24(2,3)19(25(4,5)6)15(18(22)23-26(7,8)9)12-14-10-11-16(20)17(21)13-14/h10-11,13,15,20-21H,12H2,1-9H3
InChIKey SMRZIPCULYTDHM-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 413.736 g/mol
Nominal Mass 413 u
Quality 1000
Retention Index 2887
SMILES OC1=CC=C(C=C1O)CC(N([Si](C)(C)C)[Si](C)(C)C)C(O[Si](C)(C)C)=O
SPLASH splash10-014i-3390000000-18ec603569eef4b2e566
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms trimethylsilyl (2S)-2-(bis(trimethylsilyl)amino)-3-(3,4-dihydroxyphenyl)propanoate
Technique GC/MS
Wiley ID DD2024_033028