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Gibb-4-ene-1,10-dicarboxylic acid, 2,3-dihydroxy-1-methyl-8-methylene-, dimethyl ester, (1.alpha.,2.beta.,3.alpha.,4b.alpha.,10.beta.)-

View entire compound with spectra: 3 MS (GC)

Gibb-4-ene-1,10-dicarboxylic acid, 2,3-dihydroxy-1-methyl-8-methylene-, dimethyl ester, (1.alpha.,2.beta.,3.alpha.,4b.alpha.,10.beta.)-
SpectraBase Compound ID JgKAxbKRAkp
InChI InChI=1S/C21H28O6/c1-10-8-21-9-11(10)5-6-13(21)12-7-14(22)17(23)20(2,19(25)27-4)15(12)16(21)18(24)26-3/h7,11,13-17,22-23H,1,5-6,8-9H2,2-4H3/t11-,13-,14+,15?,16+,17-,20-,21-/m0/s1
InChIKey CHJNHADLCCIMIU-AVHIDOHBSA-N
Mol Weight 376.45 g/mol
Molecular Formula C21H28O6
Exact Mass 376.188589 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ACXJbbN7TS7
Name Gibb-4-ene-1,10-dicarboxylic acid, 2,3-dihydroxy-1-methyl-8-methylene-, dimethyl ester, (1.alpha.,2.beta.,3.alpha.,4b.alpha.,10.beta.)-
Alternate Name(s) 1H-7,9a-Methanobenz[a]azulene, gibb-4-ene-1,10-dicarboxylic acid deriv. Gibb-4-ene-1,10-dicarboxylic acid, 3-ethyl-2,7-dihydroxy-1-methyl-8-methylene-, (1.alpha.,2.beta.,3.beta.,4b.beta.,10.beta.)- Gibb-4-ene-1,10-dicarboxylic acid, 2,6-dihydroxy-1,3-dimethyl-8-methylene-, 10-methyl ester, (1.alpha.,2.beta.,3.alpha.,4b.beta.,10.beta.)- ent-3.alpha.,13-dihydroxy-2.beta.-methyl-20-norgibberella-1(10),16-diene-7,19-dioic acid 7-methyl ester Dimethyl (1alpha,2beta,3alpha,4bbeta,7beta,10beta)-2,3-dihydroxy-1-methyl-8-methylenegibb-4-ene-1,10-dicarboxylate 2.beta.-ethyl-1,1-dehydrogibberellin A1 diacid ent-3.alpha.,13-dihydroxy-2.alpha.-ethyl-20-norgibberella-1(10),16-diene-7,19-dioic acid Dimethyl ent-2.beta.,3.alpha.-dihydroxy-20-norgibberella-1(10),16-diene-7,19-dioate
CAS Registry Number 78803-72-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H28O6
InChI InChI=1S/C21H28O6/c1-10-8-21-9-11(10)5-6-13(21)12-7-14(22)17(23)20(2,19(25)27-4)15(12)16(21)18(24)26-3/h7,11,13-17,22-23H,1,5-6,8-9H2,2-4H3/t11-,13-,14+,15?,16+,17-,20-,21-/m0/s1
InChIKey CHJNHADLCCIMIU-AVHIDOHBSA-N
Molecular Weight 376.449 g/mol
SMILES O[C@@]1([C@](C2C(=C[C@]1(O)[H])[C@@]1(CC[C@@]3(C(C[C@]1([C@]2(C(=O)OC)[H])C3)=C)[H])[H])(C(=O)OC)C)[H]
SPLASH splash10-008i-1091000000-5e0f6d404c2312e07232
Source of Spectrum KC-1981-1091-0
Wiley ID 1357748