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Ethyl 4,4,5,5,5-pentafluoro-3-[(R)-1'-(hydroxymethyl)-2'-(methylsulfanylethyl)amino]-pent-2-enoate

View entire compound with spectra: 1 MS (GC)

Ethyl 4,4,5,5,5-pentafluoro-3-[(R)-1'-(hydroxymethyl)-2'-(methylsulfanylethyl)amino]-pent-2-enoate
SpectraBase Compound ID J9EfCoR6VcN
InChI InChI=1S/C11H16F5NO3S/c1-3-20-9(19)4-8(10(12,13)11(14,15)16)17-7(5-18)6-21-2/h4,7,17-18H,3,5-6H2,1-2H3/b8-4-/t7-/m1/s1
InChIKey VFLJRZSQPQQAGS-UDGZVJEDSA-N
Mol Weight 337.31 g/mol
Molecular Formula C11H16F5NO3S
Exact Mass 337.077105 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7gPwLtcG0Mg
Name Ethyl 4,4,5,5,5-pentafluoro-3-[(R)-1'-(hydroxymethyl)-2'-(methylsulfanylethyl)amino]-pent-2-enoate
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Formula C11H16F5NO3S
InChI InChI=1S/C11H16F5NO3S/c1-3-20-9(19)4-8(10(12,13)11(14,15)16)17-7(5-18)6-21-2/h4,7,17-18H,3,5-6H2,1-2H3/b8-4-/t7-/m1/s1
InChIKey VFLJRZSQPQQAGS-UDGZVJEDSA-N
Molecular Weight 337.305 g/mol
SMILES N(\C(C(C(F)(F)F)(F)F)=C/C(=O)OCC)[C@](CO)(CSC)[H]
SPLASH splash10-03dr-9220000000-4fbeb8bafbbe0a8d024b
Source of Spectrum H-86-730-2
Synonyms Ethyl (2Z)-4,4,5,5,5-pentafluoro-3-({(1R)-2-hydroxy-1-[(methylsulfanyl)methyl]ethyl}amino)-2-pentenoate Ethyl 4,4,5,5,5-pentafluoro-3-[1'-(hydroxymethyl)-2'-(methylsulfanylethyl)amino]-pent-2-enoate
Wiley ID 1525324