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(Z)-3'-(But-3-en-2-ylidene)-6-methoxy-5,7,8-trimethylspiro[chro-mane-2,1'-cyclobutane]
SpectraBase Compound ID 5LBOYaKvjpd
InChI InChI=1S/C20H26O2/c1-7-12(2)16-10-20(11-16)9-8-17-15(5)18(21-6)13(3)14(4)19(17)22-20/h7H,1,8-11H2,2-6H3/b16-12-
InChIKey UQPHMCSVFOOACY-VBKFSLOCSA-N
Mol Weight 298.43 g/mol
Molecular Formula C20H26O2
Exact Mass 298.19328 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9J0ku9gRFto
Name (Z)-3'-(But-3-en-2-ylidene)-6-methoxy-5,7,8-trimethylspiro[chro-mane-2,1'-cyclobutane]
Appearance Colourless oil
Carrier Gas Hydrogen (30 ml/min, 1.2 bar)
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 298.193280075 u
Formula C20H26O2
GC Column Optima-1-MS (30 m x 0.25 mm)
GC Oven Program Oven temp 300oC
InChI InChI=1S/C20H26O2/c1-7-12(2)16-10-20(11-16)9-8-17-15(5)18(21-6)13(3)14(4)19(17)22-20/h7H,1,8-11H2,2-6H3/b16-12-
InChIKey UQPHMCSVFOOACY-VBKFSLOCSA-N
Instrument Name Agilent HP6890-5937 N
Ionization Type EI
Literature Reference DOI 10.1002/chem.202004843
Optical Rotation [a]D20 = 5.02 (589nm) (c = 0.186/100ml, CH3Cl)
Quality 302
SMILES C1(=C(C(=C(C2=C1CCC1(O2)CC(C1)=C(C=C)C)C)C)OC)C
SPLASH splash10-004i-2940000000-a0b49f808e6cca431d70
Source of Spectrum QE-27-SM57-21 (DOI: 10.1002/chem.202004843)
Thin-Layer Chromatography 0.59 (SiO2, cHex/EtOAc, 10:1)
Wiley ID 1901999