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(+/-)-(1-Ethenyl-1,5-dimethylhex-4-enyl) Hydrogen Phthalate
SpectraBase Compound ID 5iLbbIQFZcG
InChI InChI=1S/C18H22O4/c1-5-18(4,12-8-9-13(2)3)22-17(21)15-11-7-6-10-14(15)16(19)20/h5-7,9-11H,1,8,12H2,2-4H3,(H,19,20)
InChIKey BZVOYAZPMKZJOH-UHFFFAOYSA-N
Mol Weight 302.37 g/mol
Molecular Formula C18H22O4
Exact Mass 302.151809 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EIsUCelOcTV
Name (+/-)-(1-Ethenyl-1,5-dimethylhex-4-enyl) Hydrogen Phthalate
Alternate Name(s) 2-(((3,7-dimethylocta-1,6-dien-3-yl)oxy)carbonyl)benzoic acid
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Formula C18H22O4
InChI InChI=1S/C18H22O4/c1-5-18(4,12-8-9-13(2)3)22-17(21)15-11-7-6-10-14(15)16(19)20/h5-7,9-11H,1,8,12H2,2-4H3,(H,19,20)
InChIKey BZVOYAZPMKZJOH-UHFFFAOYSA-N
Literature Reference DOI 10.1002/cbdv.200890217
Molecular Weight 302.370 g/mol
SMILES OC(=O)c1ccccc1C(=O)OC(CCC=C(C)C)(C)C=C
SPLASH splash10-0007-9500000000-6be32e383b7e8e242315
Source of Spectrum CBD-5-2634-12
Wiley ID 1790360