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6,6,9-trimethyl-3-pentyl-6H-benzo[c]chromen-1-yl benzoate
SpectraBase Compound ID FNtCHYcjzau
InChI InChI=1S/C28H30O3/c1-5-6-8-11-20-17-24(30-27(29)21-12-9-7-10-13-21)26-22-16-19(2)14-15-23(22)28(3,4)31-25(26)18-20/h7,9-10,12-18H,5-6,8,11H2,1-4H3
InChIKey YYKGXLMEOVVWRG-UHFFFAOYSA-N
Mol Weight 414.55 g/mol
Molecular Formula C28H30O3
Exact Mass 414.219495 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JGlkX3KbzKy
Name 6,6,9-Trimethyl-3-pentyl-6H-benzo[c]chromen-1-yl benzoate
Classification Cannabis ingredient derivative
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 414.219494823 u
Formula C28H30O3
InChI InChI=1S/C28H30O3/c1-5-6-8-11-20-17-24(30-27(29)21-12-9-7-10-13-21)26-22-16-19(2)14-15-23(22)28(3,4)31-25(26)18-20/h7,9-10,12-18H,5-6,8,11H2,1-4H3
InChIKey YYKGXLMEOVVWRG-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 414.545 g/mol
Nominal Mass 414 u
Quality 997
Retention Index 3109
SMILES C1=2C3=C(OC(C2C=CC(=C1)C)(C)C)C=C(C=C3OC(C=1C=CC=CC1)=O)CCCCC
SPLASH splash10-0a4i-1911000000-9dae0627111f104bc043
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 6,6,9-trimethyl-3-pentyl-6H-benzo[c]chromen-1-yl benzoate
Technique GC/MS
Wiley ID DD2024_034563