SpectraBase Spectrum ID |
LBgYlGiB5cI |
Name |
[2-{4'-(Formylhexahydro-5-[(tetrahydro-2H-pyran-2"-yl)oxy]-(1H)-pentanylidene]ethoxy}-1,1-dimethylethyl acetate |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C22H34O6 |
InChI |
InChI=1S/C22H34O6/c1-22(2,3)28-20(24)14-25-9-7-15-10-16-12-19(18(13-23)17(16)11-15)27-21-6-4-5-8-26-21/h7,13,16-19,21H,4-6,8-12,14H2,1-3H3/b15-7+/t16-,17-,18+,19+,21?/m0/s1 |
InChIKey |
NRESYFLYQLLUCV-KRPVZCCXSA-N |
Molecular Weight |
394.508 g/mol |
SMILES |
[C@]12([C@]([C@](OC3OCCCC3)(C[C@@]1(C\C(C2)=C/COCC(OC(C)(C)C)=O)[H])[H])(C=O)[H])[H] |
SPLASH |
splash10-000i-9100000000-49e4a60ff66135c2d336 |
Source of Spectrum |
U-1997-2440-24 |
Synonyms |
[2-{4'-(Formylhexahydro-5-[(tetrahydro-2H-pyran-2''-yl)oxy]-(1H)-pentanylidene]ethoxy}-1,1-dimethylethyl acetate
{2-[(3aS,4R,5R,6aS)-4-Formyl-5-(2H-pyran-2-yloxy)-hexahydro-pentalen-(2E)-ylidene]-ethoxy}-acetic acid tert-butyl ester |
Wiley ID |
820296 |