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2-[(1S,2R,3S)-3-ethyl-5-keto-2-phenyl-cyclopentyl]acetic acid tert-butyl ester
SpectraBase Compound ID IYVCD14vX6p
InChI InChI=1S/C19H26O3/c1-5-13-11-16(20)15(12-17(21)22-19(2,3)4)18(13)14-9-7-6-8-10-14/h6-10,13,15,18H,5,11-12H2,1-4H3/t13-,15+,18-/m0/s1
InChIKey KJQYZDGRWVLBCW-JOQOYGCGSA-N
Mol Weight 302.41 g/mol
Molecular Formula C19H26O3
Exact Mass 302.188195 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID uWCV8Q8a49
Name 2-[(1S,2R,3S)-3-ethyl-5-keto-2-phenyl-cyclopentyl]acetic acid tert-butyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H26O3
InChI InChI=1S/C19H26O3/c1-5-13-11-16(20)15(12-17(21)22-19(2,3)4)18(13)14-9-7-6-8-10-14/h6-10,13,15,18H,5,11-12H2,1-4H3/t13-,15+,18-/m0/s1
InChIKey KJQYZDGRWVLBCW-JOQOYGCGSA-N
Molecular Weight 302.414 g/mol
SMILES [C@@]1(C(C[C@@]([C@]1(c1ccccc1)[H])(CC)[H])=O)(CC(OC(C)(C)C)=O)[H]
SPLASH splash10-000i-0940000000-e9f1131e5537d04c94e8
Source of Spectrum J-59-344-35
Synonyms 2-[(1S,2R,3S)-3-ethyl-5-oxo-2-phenylcyclopentyl]acetic acid tert-butyl ester tert-Butyl 2-[(1S,2R,3S)-3-ethyl-5-oxidanylidene-2-phenyl-cyclopentyl]ethanoate tert-Butyl 2-[(1S,2R,3S)-3-ethyl-5-oxo-2-phenyl-cyclopentyl]acetate
Wiley ID 1305004