SpectraBase Spectrum ID |
8H9Dw8yRj22 |
Name |
8-[(2R,3R,4S,6R)-4-chloro-6-hexyl-2-phenyl-3-oxanyl]octanoic acid methyl ester |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C26H41ClO3 |
InChI |
InChI=1S/C26H41ClO3/c1-3-4-5-12-17-22-20-24(27)23(26(30-22)21-15-10-9-11-16-21)18-13-7-6-8-14-19-25(28)29-2/h9-11,15-16,22-24,26H,3-8,12-14,17-20H2,1-2H3/t22-,23+,24+,26+/m1/s1 |
InChIKey |
URMOPBPTRMLKJO-APFRJGHOSA-N |
Molecular Weight |
437.064 g/mol |
SMILES |
[C@]1([C@]([C@@](Cl)(C[C@](O1)(CCCCCC)[H])[H])(CCCCCCCC(=O)OC)[H])(c1ccccc1)[H] |
SPLASH |
splash10-0gvk-0091300000-539e44e372b1b4dab214 |
Source of Spectrum |
U1-0-2636-3 |
Synonyms |
8-[(2R,3R,4S,6R)-4-chloro-6-hexyl-2-phenyl-tetrahydropyran-3-yl]caprylic acid methyl ester
Methyl 8-[(2R,3R,4S,6R)-4-chloranyl-6-hexyl-2-phenyl-oxan-3-yl]octanoate
Methyl 8-[(2R,3R,4S,6R)-4-chloro-6-hexyl-2-phenyl-tetrahydropyran-3-yl]octanoate
Methyl 8-[(2R,3R,4S,6R)-4-chloro-6-hexyl-2-phenyloxan-3-yl]octanoate |
Wiley ID |
1589957 |