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3-[(3-fluoroanilino)-oxomethyl]-1,2,2-trimethyl-1-cyclopentanecarboxylic acid
SpectraBase Compound ID Isx7eMJewZV
InChI InChI=1S/C16H20FNO3/c1-15(2)12(7-8-16(15,3)14(20)21)13(19)18-11-6-4-5-10(17)9-11/h4-6,9,12H,7-8H2,1-3H3,(H,18,19)(H,20,21)/t12-,16+/m1/s1
InChIKey AOXBTQRAYTUQPX-WBMJQRKESA-N
Mol Weight 293.34 g/mol
Molecular Formula C16H20FNO3
Exact Mass 293.142722 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9UwBqaqOKXX
Name 3-[(3-fluoroanilino)-oxomethyl]-1,2,2-trimethyl-1-cyclopentanecarboxylic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H20FNO3
InChI InChI=1S/C16H20FNO3/c1-15(2)12(7-8-16(15,3)14(20)21)13(19)18-11-6-4-5-10(17)9-11/h4-6,9,12H,7-8H2,1-3H3,(H,18,19)(H,20,21)/t12-,16+/m1/s1
InChIKey AOXBTQRAYTUQPX-WBMJQRKESA-N
Molecular Weight 293.338 g/mol
SMILES OC([C@]1(C([C@@](C(Nc2cc(F)ccc2)=O)(CC1)[H])(C)C)C)=O
SPLASH splash10-08fr-5900000000-2b60a18c5ad33beb97b8
Synonyms 3-[(3-fluorophenyl)carbamoyl]-1,2,2-trimethyl-cyclopentane-1-carboxylic acid 3-[(3-fluorophenyl)carbamoyl]-1,2,2-trimethyl-cyclopentanecarboxylic acid Cyclopentanecarboxylic acid, 3-(3-fluorophenylcarbamoyl)-1,2,2-trimethyl-
Wiley ID 1447682