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5-Dimethylheptylcannabigerol
SpectraBase Compound ID DdfxmvsfS8I
InChI InChI=1S/C25H40O2/c1-7-8-9-10-16-25(5,6)21-17-23(26)22(24(27)18-21)15-14-20(4)13-11-12-19(2)3/h12,14,17-18,26-27H,7-11,13,15-16H2,1-6H3/b20-14+
InChIKey AWTDUWTUEFDGAD-XSFVSMFZSA-N
Mol Weight 372.6 g/mol
Molecular Formula C25H40O2
Exact Mass 372.302831 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID tn1tS3g9iI
Name 5-Dimethylheptylcannabigerol
Alternate Name(s) 5-(1,1-dimethylheptyl)-2-[(2E)-3,7-dimethyl-2,6-octadienyl]-1,3-benzenediol 5-(1,1-dimethylheptyl)-2-[(2E)-3,7-dimethylocta-2,6-dienyl]benzene-1,3-diol 2-[(2E)-3,7-dimethylocta-2,6-dienyl]-5-(2-methyloctan-2-yl)benzene-1,3-diol
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Formula C25H40O2
InChI InChI=1S/C25H40O2/c1-7-8-9-10-16-25(5,6)21-17-23(26)22(24(27)18-21)15-14-20(4)13-11-12-19(2)3/h12,14,17-18,26-27H,7-11,13,15-16H2,1-6H3/b20-14+
InChIKey AWTDUWTUEFDGAD-XSFVSMFZSA-N
Molecular Weight 372.593 g/mol
SMILES Oc1c(c(cc(c1)C(CCCCCC)(C)C)O)C\C=C\(CCC=C(C)C)C
SPLASH splash10-0072-0293000000-3167cd47d2b82dd4154c
Source of Spectrum QB-16-296-16
Wiley ID 841475