| SpectraBase Spectrum ID |
LLljD4qv1GZ |
| Name |
Hexanoic acid, 2-ethyl-, cholest-5-en-3-yl ester |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
512.459331170 u |
| Formula |
C35H60O2 |
| InChI |
InChI=1S/C35H60O2/c1-8-10-14-26(9-2)33(36)37-28-19-21-34(6)27(23-28)15-16-29-31-18-17-30(25(5)13-11-12-24(3)4)35(31,7)22-20-32(29)34/h15,24-26,28-32H,8-14,16-23H2,1-7H3 |
| InChIKey |
MOWZDRPKXFFKDM-UHFFFAOYSA-N |
| Molecular Weight |
512.863 g/mol |
| SMILES |
CCCCC(CC)C(=O)OC1CCC2(C)C3CCC4(C)C(CCC4C3CC=C2C1)C(C)CCCC(C)C |
