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Cannabicitran
SpectraBase Compound ID HSNsaT99ZS1
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/t15-,16+,21-/m0/s1
InChIKey IXJXRDCCQRZSDV-MRUHUIDDSA-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 J05DxJYHAcr
Name 2,4-Ethano-2H-pyrano[4,3,2-de]-1-benzopyran, 3,3a,4,5-tetrahydro-2,5,5-trimethyl-8-pentyl-, (2.alpha.,3a.beta.,4.alpha.)-
Alternate Name(s) 1,5,5-trimethyl-9-pentyl-6,15-dioxatetracyclo[9.3.1.0(4,13).0(7,12)]pentadeca-7,9,11-triene Cannabicitran Cannabieitran Citrylidenecannabis
CAS Registry Number 31508-71-1
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/t15-,16+,21-/m0/s1
InChIKey IXJXRDCCQRZSDV-MRUHUIDDSA-N
Molecular Weight 314.469 g/mol
SMILES c12[C@@]3([C@@]4(C(C)(C)Oc2cc(CCCCC)cc1O[C@](C3)(CC4)C)[H])[H]
SPLASH splash10-001i-0092000000-92e04982532fbb378964
Source of Spectrum KO-7-249-1
Wiley ID 1315582