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(2R,3S,4S)-Dimethyl-3,4-dihydro-5-isopropyloxy-2-phenyl-2-trifluoromethyl-2H-pyrrole-3,4-dicarboxylate
SpectraBase Compound ID IUpVO82tCC8
InChI InChI=1S/C18H20F3NO5/c1-10(2)27-14-12(15(23)25-3)13(16(24)26-4)17(22-14,18(19,20)21)11-8-6-5-7-9-11/h5-10,12-13H,1-4H3/t12-,13+,17-/m0/s1
InChIKey ADNVIKQRRQMKNZ-AHIWAGSCSA-N
Mol Weight 387.36 g/mol
Molecular Formula C18H20F3NO5
Exact Mass 387.129357 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1pFwCRt41w
Name (2R,3S,4S)-Dimethyl-3,4-dihydro-5-isopropyloxy-2-phenyl-2-trifluoromethyl-2H-pyrrole-3,4-dicarboxylate
Alternate Name(s) Dimethyl (2R,3S,4S)-5-isopropoxy-2-phenyl-2-(trifluoromethyl)-3,4-dihydro-2H-pyrrole-3,4-dicarboxylate Dimethyl trans-3,4-dihydro-5-isopropyloxy-2-phenyl-2-trifluoromethyl-2H-pyrrole-3,4-dicarboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H20F3NO5
InChI InChI=1S/C18H20F3NO5/c1-10(2)27-14-12(15(23)25-3)13(16(24)26-4)17(22-14,18(19,20)21)11-8-6-5-7-9-11/h5-10,12-13H,1-4H3/t12-,13+,17-/m0/s1
InChIKey ADNVIKQRRQMKNZ-AHIWAGSCSA-N
Molecular Weight 387.355 g/mol
SMILES [C@@]1([C@]([C@](C(=O)OC)(C(=N1)OC(C)C)[H])(C(=O)OC)[H])(C(F)(F)F)c1ccccc1
SPLASH splash10-01ot-1921000000-5b8f36f8d64d76dc51ec
Source of Spectrum H1-47-788-9
Wiley ID 816205