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(1R,4E)-4-Chloro-1-hydroxy-1-phenyloct-4-en-3-one
SpectraBase Compound ID IMbIZVhpj4b
InChI InChI=1S/C14H17ClO2/c1-2-3-9-12(15)14(17)10-13(16)11-7-5-4-6-8-11/h4-9,13,16H,2-3,10H2,1H3/b12-9+/t13-/m1/s1
InChIKey AEUKYPDBUCBVJA-CNELAYHGSA-N
Mol Weight 252.74 g/mol
Molecular Formula C14H17ClO2
Exact Mass 252.091707 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8Eju1l9yk8S
Name (1R,4E)-4-Chloro-1-hydroxy-1-phenyloct-4-en-3-one
Alternate Name(s) (1R,4E)-4-chloro-1-hydroxy-1-phenyl-4-octen-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H17ClO2
InChI InChI=1S/C14H17ClO2/c1-2-3-9-12(15)14(17)10-13(16)11-7-5-4-6-8-11/h4-9,13,16H,2-3,10H2,1H3/b12-9+/t13-/m1/s1
InChIKey AEUKYPDBUCBVJA-CNELAYHGSA-N
Molecular Weight 252.741 g/mol
SMILES O[C@](CC(\C(=C/CCC)Cl)=O)(c1ccccc1)[H]
SPLASH splash10-004i-9110000000-32d5804ac7c89f08973d
Source of Spectrum C5-2004-2458-9
Wiley ID 1617317