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(1S*,5S*)-ethyl 3-hydroxy-1,4-dimethyl-2-oxo-5-phenylcyclopent-3-enecarboxylate
SpectraBase Compound ID 34vtSaI28gI
InChI InChI=1S/C16H18O4/c1-4-20-15(19)16(3)12(10(2)13(17)14(16)18)11-8-6-5-7-9-11/h5-9,12,17H,4H2,1-3H3/t12-,16+/m1/s1
InChIKey BJDXQTKONLUYQM-WBMJQRKESA-N
Mol Weight 274.32 g/mol
Molecular Formula C16H18O4
Exact Mass 274.120509 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GJtogaHhyUs
Name (1S*,5S*)-ethyl 3-hydroxy-1,4-dimethyl-2-oxo-5-phenylcyclopent-3-enecarboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H18O4
InChI InChI=1S/C16H18O4/c1-4-20-15(19)16(3)12(10(2)13(17)14(16)18)11-8-6-5-7-9-11/h5-9,12,17H,4H2,1-3H3/t12-,16+/m1/s1
InChIKey BJDXQTKONLUYQM-WBMJQRKESA-N
Literature Reference DOI 10.1002/anie.201201724
Molecular Weight 274.316 g/mol
SMILES OC=1C(=O)[C@]([C@](C1C)(c1ccccc1)[H])(C(OCC)=O)C
SPLASH splash10-00gr-8690000000-4bbb671dcaaeb36aba22
Source of Spectrum ACI-51-SMS23-5
Synonyms Ethyl (1S,5S)-3-hydroxy-1,4-dimethyl-2-oxo-5-phenylcyclopent-3-ene-1-carboxylate
Wiley ID 1780305