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MDA Glucose 4TMS
SpectraBase Compound ID 3YKDh230hgG
InChI InChI=1S/C28H55NO7Si4/c1-21(16-22-14-15-23-24(17-22)32-20-31-23)29-27(26(35-39(8,9)10)19-33-37(2,3)4)28(36-40(11,12)13)25(18-30)34-38(5,6)7/h14-15,17-18,21,25-29H,16,19-20H2,1-13H3
InChIKey YKRXNYCNIRPGBM-UHFFFAOYSA-N
Mol Weight 630.1 g/mol
Molecular Formula C28H55NO7Si4
Exact Mass 629.305559 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Dm4XVbHWe2q
Name MDA Glucose 4TMS
Classification Designer drug derivative
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 629.305559248 u
Formula C28H55NO7Si4
InChI InChI=1S/C28H55NO7Si4/c1-21(16-22-14-15-23-24(17-22)32-20-31-23)29-27(26(35-39(8,9)10)19-33-37(2,3)4)28(36-40(11,12)13)25(18-30)34-38(5,6)7/h14-15,17-18,21,25-29H,16,19-20H2,1-13H3
InChIKey YKRXNYCNIRPGBM-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 630.088 g/mol
Nominal Mass 629 u
Quality 996
Retention Index 2648
SMILES C(C(C(O[Si](C)(C)C)C=O)O[Si](C)(C)C)(C(CO[Si](C)(C)C)O[Si](C)(C)C)NC(CC1=CC2=C(C=C1)OCO2)C
SPLASH splash10-000i-2931000000-833780f1633397d8290d
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 4-((1-(1,3-benzodioxol-5-yl)propan-2-yl)amino)-2,3,5,6-tetrakis((trimethylsilyl)oxy)hexanal
Technique GC/MS
Wiley ID DD2024_019583