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(3R,5S)-3-Methyl-5-[5-(trifluoroacetyloxy)pentyl]-N-trifluoroacetylpyrrolidin-2-one
SpectraBase Compound ID EIUgX7AOIGh
InChI InChI=1S/C14H17F6NO4/c1-8-7-9(21(10(8)22)11(23)13(15,16)17)5-3-2-4-6-25-12(24)14(18,19)20/h8-9H,2-7H2,1H3/t8-,9+/m1/s1
InChIKey DDJIXPPXBNCNJD-BDAKNGLRSA-N
Mol Weight 377.28 g/mol
Molecular Formula C14H17F6NO4
Exact Mass 377.106177 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BBsk6F3NlgK
Name (3R,5S)-3-Methyl-5-[5-(trifluoroacetyloxy)pentyl]-N-trifluoroacetylpyrrolidin-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H17F6NO4
InChI InChI=1S/C14H17F6NO4/c1-8-7-9(21(10(8)22)11(23)13(15,16)17)5-3-2-4-6-25-12(24)14(18,19)20/h8-9H,2-7H2,1H3/t8-,9+/m1/s1
InChIKey DDJIXPPXBNCNJD-BDAKNGLRSA-N
Molecular Weight 377.283 g/mol
SMILES C(N1C([C@](C)(C[C@@]1(CCCCCOC(C(F)(F)F)=O)[H])[H])=O)(C(F)(F)F)=O
SPLASH splash10-00kf-6900000000-222b777e406e167aea60
Source of Spectrum AT-38-382-3
Synonyms 5-[(2S,4R)-4-methyl-5-oxo-1-(trifluoroacetyl)pyrrolidinyl]pentyl trifluoroacetate
Wiley ID 853765