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(S)-4-tert-butoxy-1-phenyl-1-penten-3-one
SpectraBase Compound ID 3X48GMD8A64
InChI InChI=1S/C15H20O2/c1-12(17-15(2,3)4)14(16)11-10-13-8-6-5-7-9-13/h5-12H,1-4H3/b11-10+/t12-/m0/s1
InChIKey YWXPEDUSLYPBCF-IIANPFDCSA-N
Mol Weight 232.32 g/mol
Molecular Formula C15H20O2
Exact Mass 232.14633 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Fi4S9x70BF2
Name (S)-4-tert-butoxy-1-phenyl-1-penten-3-one
CAS Registry Number 91111-02-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H20O2
InChI InChI=1S/C15H20O2/c1-12(17-15(2,3)4)14(16)11-10-13-8-6-5-7-9-13/h5-12H,1-4H3/b11-10+/t12-/m0/s1
InChIKey YWXPEDUSLYPBCF-IIANPFDCSA-N
Molecular Weight 232.323 g/mol
SMILES C(\C=C\c1ccccc1)([C@@](OC(C)(C)C)(C)[H])=O
SPLASH splash10-0kai-6900000000-1c4f2343288d46153261
Source of Spectrum J-53-5412-13
Synonyms (1E,4S)-4-tert-butoxy-1-phenyl-1-penten-3-one
Wiley ID 1234217