KQJGPGHQDDZVHJ-ZFOCBLLKSA-N
Compound with spectra: 4 NMR, and 1 MS (GC)
| SpectraBase Compound ID | Lc0WDilcdi8 |
|---|---|
| InChI | InChI=1S/C12H20O5/c1-2-5-10-11(15)8(13)6-3-4-7-9(14)12(16)17-10/h3,6,8-11,13-15H,2,4-5,7H2,1H3/b6-3+/t8-,9+,10+,11-/m0/s1 |
| InChIKey | KQJGPGHQDDZVHJ-ZFOCBLLKSA-N |
| Mol Weight | 244.29 g/mol |
| Molecular Formula | C12H20O5 |
| Exact Mass | 244.131074 g/mol |
| Enantiomer InChIKey | KQJGPGHQDDZVHJ-ZRRHNNCGSA-N |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Spectrum | F-56-5343-2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|---|
| Solvent | CD3OD |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|---|
| Solvent | CDCl3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|---|
| Solvent | CDCl3 |
- HERBARUMIN-II;MAJOR-CONFORMER
- HERBARUMIN-II;MINOR-CONFORMER
- HERBARUMIN-II
- Herbarumin II [(7S,8S,9R)-2,7,8-Trihydroxy-9-propyl-5-nonen-9-olide]
D-Glycero-L-manno-heptonic gamma-lactone
alpha-D-Glucoheptonic gamma-lactone
Oxacyclotetradec-10-en-2-one, 14-pentyl-13-[(trimethylsilyl)oxy]-, [13S-(10Z,13R*,14R*)]-
PHOMOLIDE-H;(7S*,8S*,10R*,E*)-4,7-DIHYDROXY-8-METHOXY-10-PROPYL-3,4,7,8,9,10-HEXAHYDRO-2H-OXECIN-2-ONE
PAWNIXGSPGYTKY-RJRPDRGMSA-N
(-)MENTHYL (2R,4E)-2-HYDROXY-6-OXO-4-HEXENOATE
(-)MENTHYL (2S,4E)-2-HYDROXY-6-OXO-4-HEXENOATE
4,9-Dioxatricyclo[6.1.0.0(3,5)]non-6-en-2-ol, acetate, (1.alpha.,2.alpha.,3.beta.,5.beta.,8.alpha.)-
DL-(1-ALPHA,2-ALPHA,3-BETA,5-BETA,8-ALPHA)-4,9-DIOXATRICYCLO-[6.1.0.0(3,5)]-NON-6-EN-2-OL-ACETATE
(9S,10R)-10-(hydroxymethyl)-9-(4-methoxybenzyloxy)-3,4,5,8,9,10-hexahydro-2H-oxecin-2-one
| Title | Journal or Book | Year |
|---|---|---|
| Total Syntheses of the Phytotoxic Lactones Herbarumin I and II and a Synthesis-Based Solution of the Pinolidoxin Puzzle | Journal of the American Chemical Society | 2002 |
This compound is available in the following databases:
KnowItAll NMR Spectral Library
Author: Wiley
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KnowItAll Mass Spectral Library
Author: Wiley
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