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cis-3'-(Hex-1-yn-1-yl)-6-methoxy-5,7,8-trimethylspiro[chro-mane-2,1'-cyclobutan]-3'-ol
SpectraBase Compound ID IP5BFTgkPlK
InChI InChI=1S/C22H30O3/c1-6-7-8-9-11-21(23)13-22(14-21)12-10-18-17(4)19(24-5)15(2)16(3)20(18)25-22/h23H,6-8,10,12-14H2,1-5H3
InChIKey ZNAFZFSJOWWQNR-UHFFFAOYSA-N
Mol Weight 342.48 g/mol
Molecular Formula C22H30O3
Exact Mass 342.219495 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BSpiOxJlP3A
Name cis-3'-(Hex-1-yn-1-yl)-6-methoxy-5,7,8-trimethylspiro[chro-mane-2,1'-cyclobutan]-3'-ol
Appearance Colourless solid
Carrier Gas Hydrogen (30 ml/min, 1.2 bar)
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H30O3
GC Column Optima-1-MS (30 m x 0.25 mm)
GC Oven Program Oven temp 300oC
InChI InChI=1S/C22H30O3/c1-6-7-8-9-11-21(23)13-22(14-21)12-10-18-17(4)19(24-5)15(2)16(3)20(18)25-22/h23H,6-8,10,12-14H2,1-5H3
InChIKey ZNAFZFSJOWWQNR-UHFFFAOYSA-N
Instrument Name Agilent HP6890-5937 N
Ionization Type EI
Literature Reference DOI 10.1002/chem.202004843
Molecular Weight 342.479 g/mol
Quality 206
SMILES OC1(CC2(CCC3=C(C(=C(C(=C3C)OC)C)C)O2)C1)C#CCCCC
SPLASH splash10-0gb9-2391000000-409689e33fa635fd72f9
Source of Spectrum QE-27-SM30-11'n (DOI: 10.1002/chem.202004843)
Thin-Layer Chromatography 0.50 (SiO2, cHex/EtOAc, 5:1)
Wiley ID 1901981