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(7S)-2,8(19),12(20)-Cembratiene-4,6,7,11-tetrol

View entire compound with spectra: 1 MS (GC)

(7S)-2,8(19),12(20)-Cembratiene-4,6,7,11-tetrol
SpectraBase Compound ID ELfbzmDZSj5
InChI InChI=1S/C20H34O4/c1-13(2)16-8-6-14(3)17(21)9-7-15(4)19(23)18(22)12-20(5,24)11-10-16/h10-11,13,16-19,21-24H,3-4,6-9,12H2,1-2,5H3/b11-10+/t16-,17+,18-,19+,20-/m1/s1
InChIKey AUGGZFDFSHSURF-AVAIWUHWSA-N
Mol Weight 338.5 g/mol
Molecular Formula C20H34O4
Exact Mass 338.24571 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HePCjuz027D
Name (7S)-2,8(19),12(20)-Cembratiene-4,6,7,11-tetrol
Alternate Name(s) (1S,2R,4S,7S,11S)-7-isopropyl-4-methyl-10,14-dimethylene-5-cyclotetradecene-1,2,4,11-tetrol 7S-1-Isopropyl-2-methyl-8,12-bis(methylene)-4,6,7,11-tetrahydroxy-cyclotetradec-2-ene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H34O4
InChI InChI=1S/C20H34O4/c1-13(2)16-8-6-14(3)17(21)9-7-15(4)19(23)18(22)12-20(5,24)11-10-16/h10-11,13,16-19,21-24H,3-4,6-9,12H2,1-2,5H3/b11-10+/t16-,17+,18-,19+,20-/m1/s1
InChIKey AUGGZFDFSHSURF-AVAIWUHWSA-N
Molecular Weight 338.488 g/mol
SMILES O[C@]1(CCC([C@@]([C@@](C[C@@](\C=C\[C@@](CCC1=C)(C(C)C)[H])(O)C)(O)[H])(O)[H])=C)[H]
SPLASH splash10-052f-9300000000-d668c484d0cbe44758dd
Source of Spectrum SB-44-821-2
Wiley ID 744764