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6-Oxo-abieta-8,11,13-triene-11,12-diol
SpectraBase Compound ID 1PrVcyiKryq
InChI InChI=1S/C20H28O3/c1-11(2)13-9-12-10-14(21)18-19(3,4)7-6-8-20(18,5)15(12)17(23)16(13)22/h9,11,18,22-23H,6-8,10H2,1-5H3/t18-,20+/m0/s1
InChIKey HMSMGZICKPDMDJ-AZUAARDMSA-N
Mol Weight 316.44 g/mol
Molecular Formula C20H28O3
Exact Mass 316.203845 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID jqZe5qjZUf
Name 6-Oxo-abieta-8,11,13-triene-11,12-diol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H28O3
InChI InChI=1S/C20H28O3/c1-11(2)13-9-12-10-14(21)18-19(3,4)7-6-8-20(18,5)15(12)17(23)16(13)22/h9,11,18,22-23H,6-8,10H2,1-5H3/t18-,20+/m0/s1
InChIKey HMSMGZICKPDMDJ-AZUAARDMSA-N
Molecular Weight 316.441 g/mol
SMILES Oc1c(cc2CC([C@@]3([C@@](c2c1O)(CCCC3(C)C)C)[H])=O)C(C)C
SPLASH splash10-01b9-1197000000-cdde3a11c8dbaba5cb8c
Source of Spectrum E1-58-821-22
Synonyms (4bS,8aS)-3,4-dihydroxy-4b,8,8-trimethyl-2-propan-2-yl-6,7,8a,10-tetrahydro-5H-phenanthren-9-one (4bS,8aS)-4b,8,8-trimethyl-3,4-bis(oxidanyl)-2-propan-2-yl-6,7,8a,10-tetrahydro-5H-phenanthren-9-one
Wiley ID 1661888