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(1R,4S)-5,6-Dimethoxy-4,7-dimethyl-1-(prop-1-en-2-yl)-1,2,3,4-tetrahydronaphthalene
SpectraBase Compound ID HblDTBInKiT
InChI InChI=1S/C17H24O2/c1-10(2)13-8-7-11(3)15-14(13)9-12(4)16(18-5)17(15)19-6/h9,11,13H,1,7-8H2,2-6H3/t11-,13+/m0/s1
InChIKey SDRDCRWQVIPPTL-WCQYABFASA-N
Mol Weight 260.38 g/mol
Molecular Formula C17H24O2
Exact Mass 260.17763 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4XSbt4c5Ph9
Name (1R,4S)-5,6-Dimethoxy-4,7-dimethyl-1-(prop-1-en-2-yl)-1,2,3,4-tetrahydronaphthalene
Carrier Gas Hydrogen (1.7 ml/min, 1.2 bar)
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 260.177630011 u
Formula C17H24O2
GC Column Optima-1-MS (30 m x 0.25 mm)
GC Oven Program Oven temp 300oC
InChI InChI=1S/C17H24O2/c1-10(2)13-8-7-11(3)15-14(13)9-12(4)16(18-5)17(15)19-6/h9,11,13H,1,7-8H2,2-6H3/t11-,13+/m0/s1
InChIKey SDRDCRWQVIPPTL-WCQYABFASA-N
Instrument Name Agilent GC6890-HP 5973
Ionization Type EI
Literature Reference DOI 10.1002/chem.202101863
Molecular Weight 260.377 g/mol
Optical Rotation [a]lambda20 = -16.8 (589 nm) (c = 0.69 g/100 ml, CHCl3)
Quality 372
SMILES COC1=C(C2=C(C=C1C)[C@](CC[C@@]2(C)[H])(C(=C)C)[H])OC
SPLASH splash10-02t9-0390000000-45f9f43ae1ea7f31ff8f
Sample Comments dr = 90:10
Source of Spectrum QE-27-SM26-trans-6b (DOI: 10.1002/chem.202101863)
Thin-Layer Chromatography 0.40 (CyHex/EtOAc, 25:1)
Wiley ID 1902178