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trans-4-hydroxy-proline, 3TMS
SpectraBase Compound ID CSd5CwFbdve
InChI InChI=1S/C14H33NO3Si3/c1-19(2,3)15-11-12(17-20(4,5)6)10-13(15)14(16)18-21(7,8)9/h12-13H,10-11H2,1-9H3/t12-,13+/m1/s1
InChIKey AXDZYUJCXNVFLS-OLZOCXBDSA-N
Mol Weight 347.7 g/mol
Molecular Formula C14H33NO3Si3
Exact Mass 347.176824 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7UeiKBYRrOo
Name trans-4-hydroxy-proline, 3TMS
Comments Derivatization type: 3 TMS (mass: 347.177); CC-BY: Oliver Fiehn, University of California, Davis; MoNA-ID: FiehnLib000239; Note: The molecular formula of the structure shown is C5H9NO3 - which differs from the formula reported for the mass spectrum (C14H33NO3Si3)
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Formula C14H33NO3Si3
InChI InChI=1S/C14H33NO3Si3/c1-19(2,3)15-11-12(17-20(4,5)6)10-13(15)14(16)18-21(7,8)9/h12-13H,10-11H2,1-9H3/t12-,13+/m1/s1
InChIKey AXDZYUJCXNVFLS-OLZOCXBDSA-N
Molecular Weight 347.677 g/mol
SMILES C1[C@](CN([C@@]1(C(=O)O[Si](C)(C)C)[H])[Si](C)(C)C)(O[Si](C)(C)C)[H]
SPLASH splash10-000x-0940000000-eb9ea6e4849f4189ca94
Source of Spectrum FM-2019-239-0
Synonyms Hydroxyproline, 3TMS 4-Hydroxyproline, 3TMS Oxyproline, 3TMS cis-Hydroxyproline, 3TMS Hydroxy-L-proline, 3TMS cis-4-hydroxyproline, 3TMS 4-Hydroxypyrrolidine-2-carboxylic acid, 3TMS Trimethylsilyl (2S,4R)-1-(trimethylsilyl)-4-((trimethylsilyl)oxy)pyrrolidine-2-carboxylate
Wiley ID 1817928