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(1S,2E,4S,6R,7E,10S,11S)-10,11-Epoxy-2,7,12(20)-cembratriene-4,6-diol
SpectraBase Compound ID 8ezcKF5daWw
InChI InChI=1S/C20H32O3/c1-13(2)16-7-6-15(4)19-18(23-19)11-14(3)10-17(21)12-20(5,22)9-8-16/h8-10,13,16-19,21-22H,4,6-7,11-12H2,1-3,5H3/b9-8+,14-10+/t16-,17+,18+,19+,20-/m1/s1
InChIKey COJBNIWQOBKWQK-QBPGQINRSA-N
Mol Weight 320.5 g/mol
Molecular Formula C20H32O3
Exact Mass 320.235145 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LHl5DGJxubf
Name (1S,2E,4S,6R,7E,10S,11S)-10,11-Epoxy-2,7,12(20)-cembratriene-4,6-diol
Alternate Name(s) (10S,11S)-10,11-Epoxy-2,7,12(20)-cembatriene-4,6-diol (1S,5R,7S,10S,14S)-10-isopropyl-3,7-dimethyl-13-methylene-15-oxabicyclo[12.1.0]pentadeca-3,8-diene-5,7-diol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H32O3
InChI InChI=1S/C20H32O3/c1-13(2)16-7-6-15(4)19-18(23-19)11-14(3)10-17(21)12-20(5,22)9-8-16/h8-10,13,16-19,21-22H,4,6-7,11-12H2,1-3,5H3/b9-8+,14-10+/t16-,17+,18+,19+,20-/m1/s1
InChIKey COJBNIWQOBKWQK-QBPGQINRSA-N
Molecular Weight 320.473 g/mol
SMILES O[C@]1(C[C@](\C=C\(C[C@@]2(O[C@]2(C(CC[C@](\C=C\1)(C(C)C)[H])=C)[H])[H])C)(O)[H])C
SPLASH splash10-052f-9200000000-4f4b47c4a3801f27c12d
Source of Spectrum SB-46-793-2
Wiley ID 1320474