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(3S,4S,1E)-3,4-(cyclohexylidenedioxy)-1-phenyl-1-pentene
SpectraBase Compound ID Jykh2i9We7f
InChI InChI=1S/C17H22O2/c1-14-16(11-10-15-8-4-2-5-9-15)19-17(18-14)12-6-3-7-13-17/h2,4-5,8-11,14,16H,3,6-7,12-13H2,1H3/b11-10+/t14-,16-/m0/s1
InChIKey DQBHEKUSSSXSLH-BJCHZKIZSA-N
Mol Weight 258.36 g/mol
Molecular Formula C17H22O2
Exact Mass 258.16198 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 51bSfEAyPjO
Name (3S,4S,1E)-3,4-(cyclohexylidenedioxy)-1-phenyl-1-pentene
Alternate Name(s) (2S,3S)-2-methyl-3-[(E)-2-phenylethenyl]-1,4-dioxaspiro[4.5]decane
CAS Registry Number 116696-53-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H22O2
InChI InChI=1S/C17H22O2/c1-14-16(11-10-15-8-4-2-5-9-15)19-17(18-14)12-6-3-7-13-17/h2,4-5,8-11,14,16H,3,6-7,12-13H2,1H3/b11-10+/t14-,16-/m0/s1
InChIKey DQBHEKUSSSXSLH-BJCHZKIZSA-N
Molecular Weight 258.361 g/mol
SMILES C12(O[C@@](\C=C\c3ccccc3)([C@@](O1)(C)[H])[H])CCCCC2
SPLASH splash10-02tc-3930000000-f363443ca63d48dbd51a
Source of Spectrum J-53-5413-0
Wiley ID 1262182