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Cyclopropanecarboxylic acid, 2,2,3-trimethyl-1-(4-nitrophenyl)-, 2,2,2-trifluoroethyl ester, cis-(.+-.)-
SpectraBase Compound ID Fd16kD9irTw
InChI InChI=1S/C15H16F3NO4/c1-9-13(2,3)15(9,12(20)23-8-14(16,17)18)10-4-6-11(7-5-10)19(21)22/h4-7,9H,8H2,1-3H3/t9-,15-/m1/s1
InChIKey VBCITXHTGLOXIL-RFAUZJTJSA-N
Mol Weight 331.29 g/mol
Molecular Formula C15H16F3NO4
Exact Mass 331.103142 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8rsbmVuCe2t
Name Cyclopropanecarboxylic acid, 2,2,3-trimethyl-1-(4-nitrophenyl)-, 2,2,2-trifluoroethyl ester, cis-(.+-.)-
CAS Registry Number 129919-10-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H16F3NO4
InChI InChI=1S/C15H16F3NO4/c1-9-13(2,3)15(9,12(20)23-8-14(16,17)18)10-4-6-11(7-5-10)19(21)22/h4-7,9H,8H2,1-3H3/t9-,15-/m1/s1
InChIKey VBCITXHTGLOXIL-RFAUZJTJSA-N
Molecular Weight 331.291 g/mol
SMILES [C@]1(C(C)(C)[C@]1(C)[H])(C(OCC(F)(F)F)=O)c1ccc(N(=O)=O)cc1
SPLASH splash10-00lu-0963000000-c53cea5ea222e8d1b30c
Source of Spectrum C-112-7701-4
Synonyms 2,2,2-trifluoroethyl (1R,3R)-2,2,3-trimethyl-1-(4-nitrophenyl)cyclopropanecarboxylate syn-1,1,2-trimethyl-3-(trifluoro-ethoxy-carbonyl)-3-(p-nitrophenyl)-cyclopropane
Wiley ID 1328550