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Cannabicoumaronone
SpectraBase Compound ID 8vs37iyhWyV
InChI InChI=1S/C21H28O3/c1-5-6-7-8-15-11-18-20-16(13-23-18)17(10-9-14(2)22)21(3,4)24-19(20)12-15/h11-13,17H,5-10H2,1-4H3
InChIKey CSSYBWPIBDITMG-UHFFFAOYSA-N
Mol Weight 328.45 g/mol
Molecular Formula C21H28O3
Exact Mass 328.203845 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 48S107vfIO
Name 4-(4,4-Dimethyl-7-pentyl-3,4-dihydrofuro[4,3,2-de]chromen-3-yl)-2-butanone
Alternate Name(s) Cannabicoumaronone
CAS Registry Number 70474-97-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H28O3
InChI InChI=1S/C21H28O3/c1-5-6-7-8-15-11-18-20-16(13-23-18)17(10-9-14(2)22)21(3,4)24-19(20)12-15/h11-13,17H,5-10H2,1-4H3
InChIKey CSSYBWPIBDITMG-UHFFFAOYSA-N
Molecular Weight 328.452 g/mol
SMILES CCCCCc1cc2c3c(c1)OC(C)(C)C(CCC(C)=O)c3co2
SPLASH splash10-06vr-1194000000-dfc8fac16393ebbbf970
Source of Spectrum F-34-3210-0
Wiley ID 1326667