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(3R)-3-[(E)-2-(4-methylphenyl)ethenyl]-1-cycloheptanone
SpectraBase Compound ID FZUCPL5AZd5
InChI InChI=1S/C16H20O/c1-13-6-8-14(9-7-13)10-11-15-4-2-3-5-16(17)12-15/h6-11,15H,2-5,12H2,1H3/b11-10+/t15-/m0/s1
InChIKey YUPWJNSBHJXUGQ-NKSUMMKUSA-N
Mol Weight 228.33 g/mol
Molecular Formula C16H20O
Exact Mass 228.151415 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Lc5Xw1PsW5n
Name (3R)-3-[(E)-2-(4-methylphenyl)ethenyl]-1-cycloheptanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H20O
InChI InChI=1S/C16H20O/c1-13-6-8-14(9-7-13)10-11-15-4-2-3-5-16(17)12-15/h6-11,15H,2-5,12H2,1H3/b11-10+/t15-/m0/s1
InChIKey YUPWJNSBHJXUGQ-NKSUMMKUSA-N
Molecular Weight 228.335 g/mol
SMILES [C@]1(\C=C\c2ccc(cc2)C)(CC(=O)CCCC1)[H]
SPLASH splash10-0a6r-0910000000-eff3233dda52e214f4c4
Source of Spectrum U1-2002-3556-3
Synonyms (3R)-3-[(E)-2-(4-methylphenyl)ethenyl]cycloheptan-1-one (3R)-3-[(E)-2-(p-tolyl)vinyl]cycloheptanone
Wiley ID 1523336