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erythrose-4-phosphate, 4TMS, 1MEOX
SpectraBase Compound ID 7s2YBnafRWr
InChI InChI=1S/C17H44NO7PSi4/c1-20-18-14-16(22-27(2,3)4)17(23-28(5,6)7)15-21-26(19,24-29(8,9)10)25-30(11,12)13/h14,16-17H,15H2,1-13H3/b18-14+/t16-,17+/m0/s1
InChIKey YXTLQTDNWZABLL-NIIBVUOVSA-N
Mol Weight 517.9 g/mol
Molecular Formula C17H44NO7PSi4
Exact Mass 517.193246 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3xjfHp4AVyf
Name erythrose-4-phosphate, 4TMS, 1MEOX
Comments Derivatization type: 4 TMS (mass: 517.193); CC-BY: Oliver Fiehn, University of California, Davis; MoNA-ID: FiehnLib001076; Note: The molecular formula of the structure shown is C4H9O7P - which differs from the formula reported for the mass spectrum (C17H44NO7PSi4)
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H44NO7PSi4
InChI InChI=1S/C17H44NO7PSi4/c1-20-18-14-16(22-27(2,3)4)17(23-28(5,6)7)15-21-26(19,24-29(8,9)10)25-30(11,12)13/h14,16-17H,15H2,1-13H3/b18-14+/t16-,17+/m0/s1
InChIKey YXTLQTDNWZABLL-NIIBVUOVSA-N
Molecular Weight 517.853 g/mol
SMILES [C@@](\C=N\OC)([C@@](COP(O[Si](C)(C)C)(O[Si](C)(C)C)=O)(O[Si](C)(C)C)[H])(O[Si](C)(C)C)[H]
SPLASH splash10-0ka2-2923000000-7efba68fede11d02664d
Source of Spectrum FM-2019-1076-0
Synonyms erythrose-4P, 4TMS, 1MEOX threose 4-phosphate, 4TMS, 1MEOX erythrose-4-P, 4TMS, 1MEOX erythrose 4-phosphate, 4TMS, 1MEOX D-erythrose-4-P, 4TMS, 1MEOX D-Erythrose 4-phosphate, 4TMS, 1MEOX [(2R,3R)-2,3-dihydroxy-4-oxobutyl] dihydrogen phosphate, 4TMS, 1MEOX (2R,3S,E)-4-(methoxyimino)-2,3-bis((trimethylsilyl)oxy)butyl bis(trimethylsilyl) phosphate
Wiley ID 1818734