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(+/-)-3-[(2E)-3,7-Dimethylocta-2,6-dienyloxy]isobenzofuran-1(3H)-one
SpectraBase Compound ID AHyzUSGLVzl
InChI InChI=1S/C18H22O3/c1-13(2)7-6-8-14(3)11-12-20-18-16-10-5-4-9-15(16)17(19)21-18/h4-5,7,9-11,18H,6,8,12H2,1-3H3/b14-11+
InChIKey YTWAWWQJJBQYOL-SDNWHVSQSA-N
Mol Weight 286.37 g/mol
Molecular Formula C18H22O3
Exact Mass 286.156895 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L8Q4qMocqFx
Name (+/-)-3-[(2E)-3,7-Dimethylocta-2,6-dienyloxy]isobenzofuran-1(3H)-one
Alternate Name(s) (E)-3-((3,7-dimethylocta-2,6-dien-1-yl)oxy)isobenzofuran-1(3H)-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H22O3
InChI InChI=1S/C18H22O3/c1-13(2)7-6-8-14(3)11-12-20-18-16-10-5-4-9-15(16)17(19)21-18/h4-5,7,9-11,18H,6,8,12H2,1-3H3/b14-11+
InChIKey YTWAWWQJJBQYOL-SDNWHVSQSA-N
Literature Reference DOI 10.1002/hlca.200390236
Molecular Weight 286.371 g/mol
SMILES C1(OC(c2ccccc12)OC\C=C\(CCC=C(C)C)C)=O
SPLASH splash10-014l-9300000000-1fea6ae562b60336d82e
Source of Spectrum H-86-2890-12b
Wiley ID 1785385