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Dibenzo[a,c]cycloocten-5-ol, 5,6,7,8-tetrahydro-1,2,3,9,11-pentamethoxy-6,7-dimethyl-, [5R-(5.alpha.,6.beta.,7.alpha.)]-
SpectraBase Compound ID FIgqFdXhr3V
InChI InChI=1S/C23H30O6/c1-12-8-15-16(9-14(25-3)10-18(15)26-4)20-17(21(24)13(12)2)11-19(27-5)22(28-6)23(20)29-7/h9-13,21,24H,8H2,1-7H3/t12-,13+,21-/m1/s1
InChIKey FTVLLDAGCUAOMY-RRMDADRESA-N
Mol Weight 402.49 g/mol
Molecular Formula C23H30O6
Exact Mass 402.204239 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6z1LCwHMTsj
Name Dibenzo[a,c]cycloocten-5-ol, 5,6,7,8-tetrahydro-1,2,3,9,11-pentamethoxy-6,7-dimethyl-, [5R-(5.alpha.,6.beta.,7.alpha.)]-
CAS Registry Number 79742-42-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H30O6
InChI InChI=1S/C23H30O6/c1-12-8-15-16(9-14(25-3)10-18(15)26-4)20-17(21(24)13(12)2)11-19(27-5)22(28-6)23(20)29-7/h9-13,21,24H,8H2,1-7H3/t12-,13+,21-/m1/s1
InChIKey FTVLLDAGCUAOMY-RRMDADRESA-N
Molecular Weight 402.487 g/mol
SMILES O[C@]1(c2c(-c3c(C[C@@](C)([C@@]1(C)[H])[H])c(OC)cc(c3)OC)c(c(c(OC)c2)OC)OC)[H]
SPLASH splash10-0uxs-0509700000-7ee2b3e1a7227ce7e3d7
Source of Spectrum B-34-815-0
Synonyms (5R,6S,7R)-1,2,3,9,11-pentamethoxy-6,7-dimethyl-5,6,7,8-tetrahydrodibenzo[a,c]cycloocten-5-ol (aR,5R,6S,7R)-1,2,3,9,11-pentamethoxy-6,7-dimethyl-5,6,7,8-tetrahydrodibenzo[a,c]cycloocten-5-ol
Wiley ID 1370417