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(1R,5R,8R)-8-Hydroxy-5-methylbicyclo[3.3.1]nonan-2-one
SpectraBase Compound ID JuWitpZjl6n
InChI InChI=1S/C10H16O2/c1-10-4-2-8(11)7(6-10)9(12)3-5-10/h7-8,11H,2-6H2,1H3/t7-,8-,10-/m1/s1
InChIKey KXURMEPARMQGNP-NQMVMOMDSA-N
Mol Weight 168.24 g/mol
Molecular Formula C10H16O2
Exact Mass 168.11503 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HwQpxE9733A
Name (1R,5R,8R)-8-Hydroxy-5-methylbicyclo[3.3.1]nonan-2-one
Appearance Colorless oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H16O2
InChI InChI=1S/C10H16O2/c1-10-4-2-8(11)7(6-10)9(12)3-5-10/h7-8,11H,2-6H2,1H3/t7-,8-,10-/m1/s1
InChIKey KXURMEPARMQGNP-NQMVMOMDSA-N
Ionization Type EI
Literature Reference DOI 10.1002/ejoc.201901722
Molecular Weight 168.236 g/mol
Optical Rotation [a]D27 = -10.2 (c = 0.1, CHCl3)
Reported Formula C10H16O2
SMILES O[C@@]1(CC[C@@]2(CCC([C@@]1(C2)[H])=O)C)[H]
SPLASH splash10-00r2-9300000000-12f8629e81e684fdd94b
Source of Spectrum U1-2020-SM3-5a
Wiley ID 1858939