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13-[6'-Hydroxy-2',8'-dimethyl-3',4'-dihydro-(2H)-2-chromenyl]-2,6,10-trimethyl-2,6,10-tridecatrien-1-ol
SpectraBase Compound ID IjTf7BbLmyB
InChI InChI=1S/C27H40O3/c1-20(11-7-12-22(3)19-28)9-6-10-21(2)13-8-15-27(5)16-14-24-18-25(29)17-23(4)26(24)30-27/h9,12-13,17-18,28-29H,6-8,10-11,14-16,19H2,1-5H3/b20-9+,21-13+,22-12+
InChIKey CAGBDTBNTAQAEH-JASPXPHPSA-N
Mol Weight 412.6 g/mol
Molecular Formula C27H40O3
Exact Mass 412.297745 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CVermldarc0
Name 13-[6'-Hydroxy-2',8'-dimethyl-3',4'-dihydro-(2H)-2-chromenyl]-2,6,10-trimethyl-2,6,10-tridecatrien-1-ol
Alternate Name(s) 2-[(3E,7E,11E)-13-hydroxy-4,8,12-trimethyl-3,7,11-tridecatrienyl]-2,8-dimethyl-6-chromanol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H40O3
InChI InChI=1S/C27H40O3/c1-20(11-7-12-22(3)19-28)9-6-10-21(2)13-8-15-27(5)16-14-24-18-25(29)17-23(4)26(24)30-27/h9,12-13,17-18,28-29H,6-8,10-11,14-16,19H2,1-5H3/b20-9+,21-13+,22-12+
InChIKey CAGBDTBNTAQAEH-JASPXPHPSA-N
Molecular Weight 412.614 g/mol
SMILES OC\C(=C\CC\C(=C\CC\C(=C\CCC1(Oc2c(cc(cc2CC1)O)C)C)C)C)C
SPLASH splash10-052r-1900100000-726fd22a7ded2a772d55
Source of Spectrum OL-17-815-3
Wiley ID 1612034