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Chenabinol - methyl ether

View entire compound with spectra: 1 MS (GC)

Chenabinol - methyl ether
SpectraBase Compound ID 8vyi3SxDKfN
InChI InChI=1S/C38H44N2O7/c1-39-15-13-27-20-36(44-5)38(45-6)37(30(27)22-39)47-35-21-29-26(19-34(35)43-4)14-16-40(2)31(29)17-24-7-10-28(11-8-24)46-33-18-25(23-42-3)9-12-32(33)41/h7-12,18-21,31,41H,13-17,22-23H2,1-6H3/t31-/m0/s1
InChIKey CNXCXCAFBUHFSD-HKBQPEDESA-N
Mol Weight 640.8 g/mol
Molecular Formula C38H44N2O7
Exact Mass 640.314852 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BZaV4N0o3Ed
Name Chenabinol - methyl ether
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C38H44N2O7
InChI InChI=1S/C38H44N2O7/c1-39-15-13-27-20-36(44-5)38(45-6)37(30(27)22-39)47-35-21-29-26(19-34(35)43-4)14-16-40(2)31(29)17-24-7-10-28(11-8-24)46-33-18-25(23-42-3)9-12-32(33)41/h7-12,18-21,31,41H,13-17,22-23H2,1-6H3/t31-/m0/s1
InChIKey CNXCXCAFBUHFSD-HKBQPEDESA-N
Molecular Weight 640.777 g/mol
SMILES Oc1c(Oc2ccc(C[C@]3(c4cc(Oc5c6c(CCN(C6)C)cc(c5OC)OC)c(cc4CCN3C)OC)[H])cc2)cc(cc1)COC
SPLASH splash10-0002-0109000000-169b4235b3a149b56a79
Source of Spectrum X2-52-319-4
Wiley ID 1603045