| SpectraBase Spectrum ID |
GBGLTmd03ZB |
| Name |
Toluene-4-sulfonic acid 2-benzyloxymethyl-5-(5-methyl-hexanoyl)-cyclopentylmethyl ester |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C28H38O5S |
| InChI |
InChI=1S/C28H38O5S/c1-21(2)8-7-11-28(29)26-17-14-24(19-32-18-23-9-5-4-6-10-23)27(26)20-33-34(30,31)25-15-12-22(3)13-16-25/h4-6,9-10,12-13,15-16,21,24,26-27H,7-8,11,14,17-20H2,1-3H3/t24-,26?,27-/m0/s1 |
| InChIKey |
MNCMOZVRXBUDEG-VNBODJOOSA-N |
| Molecular Weight |
486.667 g/mol |
| SMILES |
C(OS(c1ccc(cc1)C)(=O)=O)[C@@]1(C(CC[C@]1(COCc1ccccc1)[H])C(=O)CCCC(C)C)[H] |
| SPLASH |
splash10-06r7-9831000000-bb851c9fadfe72a9dbd0 |
| Source of Spectrum |
F-51-4505-18 |
| Synonyms |
(1S,2R)-Toluene-4-sulfonic acid 2-benzyloxymethyl-5-(5-methyl-hexanoyl)-cyclopentylmethyl ester
3-(Benzyloxymethyl)-2-(hydroxymethyl)-1-(5-methyl-2-oxohexyl)cyclopentane
[2-[(benzyloxy)methyl]-5-(5-methylhexanoyl)cyclopentyl]methyl 4-methylbenzenesulfonate |
| Wiley ID |
791844 |
