| SpectraBase Spectrum ID |
5fLqJX2ukSX |
| Name |
E-10-Dicyclohexylsulfamoyl-D-isobornyl 4-Hydroxy-5-methylhex-2-enoate |
| Alternate Name(s) |
1-{[(dicyclohexylamino)sulfonyl]methyl}-7,7-dimethylbicyclo[2.2.1]hept-2-yl (2E)-4-hydroxy-5-methyl-2-hexenoate |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C29H49NO5S |
| InChI |
InChI=1S/C29H49NO5S/c1-21(2)25(31)15-16-27(32)35-26-19-22-17-18-29(26,28(22,3)4)20-36(33,34)30(23-11-7-5-8-12-23)24-13-9-6-10-14-24/h15-16,21-26,31H,5-14,17-20H2,1-4H3/b16-15+/t22-,25?,26-,29-/m1/s1 |
| InChIKey |
VWSOMEOQODRFML-SFMQHBCFSA-N |
| Molecular Weight |
523.773 g/mol |
| SMILES |
OC(\C=C\C(O[C@]1([C@@]2(CS(N(C3CCCCC3)C3CCCCC3)(=O)=O)C([C@](CC2)(C1)[H])(C)C)[H])=O)C(C)C |
| SPLASH |
splash10-004i-0900010000-0fb75486e0b205210cfe |
| Source of Spectrum |
F-47-6615-12 |
| Wiley ID |
1402405 |
