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Cannabicitran
SpectraBase Compound ID FjB4raiYdjf
InChI InChI=1S/C21H30O2/c1-5-6-7-8-14-11-17-19-15-13-21(4,23-18(19)12-14)10-9-16(15)20(2,3)22-17/h11-12,15-16H,5-10,13H2,1-4H3
InChIKey IXJXRDCCQRZSDV-UHFFFAOYSA-N
Mol Weight 314.47 g/mol
Molecular Formula C21H30O2
Exact Mass 314.22458 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5g4oiXxzaEj
Name Cannabicitran
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H30O2
InChI InChI=1S/C21H30O2/c1-5-6-7-8-14-11-17-19-15-13-21(4,23-18(19)12-14)10-9-16(15)20(2,3)22-17/h11-12,15-16H,5-10,13H2,1-4H3
InChIKey IXJXRDCCQRZSDV-UHFFFAOYSA-N
Instrument Name Thermo Scientific DSQII
Ionization Type EI
Literature Reference DOI 10.1021/acs.jnatprod.1c00567
Molecular Weight 314.469 g/mol
SMILES c12c3c(cc(c2)CCCCC)OC(C2C3CC(O1)(CC2)C)(C)C
SPLASH splash10-001i-2291000000-91505c08a7af15eb7a42
Source of Spectrum G4-84-SM21-12, CBT
Wiley ID 1884107