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(R)-cyclohepta-2,4,6-trien-1-yl(cyclohex-2-en-1-yl)methanol
SpectraBase Compound ID CwEMJ8GyNFX
InChI InChI=1S/C14H18O/c15-14(13-10-6-3-7-11-13)12-8-4-1-2-5-9-12/h1-2,4-6,8-10,12-15H,3,7,11H2/t13?,14-/m0/s1
InChIKey SFUQTYRYMHUSGS-KZUDCZAMSA-N
Mol Weight 202.3 g/mol
Molecular Formula C14H18O
Exact Mass 202.135765 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KHJ1diPj5sM
Name (R)-cyclohepta-2,4,6-trien-1-yl(cyclohex-2-en-1-yl)methanol
Appearance Colourless oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 202.135765199 u
Formula C14H18O
InChI InChI=1S/C14H18O/c15-14(13-10-6-3-7-11-13)12-8-4-1-2-5-9-12/h1-2,4-6,8-10,12-15H,3,7,11H2/t13?,14-/m0/s1
InChIKey SFUQTYRYMHUSGS-KZUDCZAMSA-N
Instrument Name Agilent 7890A-5975
Ionization Type EI
Literature Reference DOI 10.1002/adsc.202300121
Molecular Weight 202.297 g/mol
Optical Rotation [a]D20 = -53.6 (c = 1.0, CH2Cl2)
Quality 914
Reported Formula C14H18O
SMILES O[C@@](C1C=CC=CC=C1)(C1C=CCCC1)[H]
SPLASH splash10-0006-9300000000-cc01309e78d0b5e670e6
Sample Comments 88% ee
Source of Spectrum ASC-365-SM9-5g (DOI: 10.1002/adsc.202300121)
Wiley ID 1902745