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(R)-1-(3,4-dimethylcyclohex-3-en-1-yl)ethan-1-one
SpectraBase Compound ID 6LUpSLwLgru
InChI InChI=1S/C10H16O/c1-7-4-5-10(9(3)11)6-8(7)2/h10H,4-6H2,1-3H3/t10-/m1/s1
InChIKey RURLNOKRSSLTSA-SNVBAGLBSA-N
Mol Weight 152.24 g/mol
Molecular Formula C10H16O
Exact Mass 152.120115 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4K5ScTdeJO1
Name (R)-1-(3,4-dimethylcyclohex-3-en-1-yl)ethan-1-one
Appearance Colourless oil
Carrier Gas Helium
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 152.120115134 u
Formula C10H16O
GC Column HP5-MS (30 m x 0.25 mm, film thickness 0.50 micrometer)
GC Oven Program Oven temp 50oC
InChI InChI=1S/C10H16O/c1-7-4-5-10(9(3)11)6-8(7)2/h10H,4-6H2,1-3H3/t10-/m1/s1
InChIKey RURLNOKRSSLTSA-SNVBAGLBSA-N
Inlet Type Splitless/split (50:1)
Instrument Name Agilent 7890B-5977A series
Ionization Type EI
Literature Reference DOI 10.3762/bjoc.18.82
Molecular Weight 152.237 g/mol
Optical Rotation [a]D20 = +49.9 (c = 1.0, CHCl3)
Quality 367
SMILES C(C)(=O)[C@]1(CC(=C(CC1)C)C)[H]
SPLASH splash10-0a4l-9800000000-9a338a8b896b0aef760b
Source of Spectrum BJO-18-SM11-(R)-S1 (DOI: 10.3762/bjoc.18.82)
Thin-Layer Chromatography 0.55 (cyclohexane/ethyl acetate, 5:1)
Wiley ID 1901327