SpectraBase Spectrum ID |
BI65YOj8tun |
Name |
2-[(4-(iodoacetyl)-3-acetoxybutyl]-2,6-dimethyl-7-(1,5-dimethylhexyl)hexahydroindane[4,5-c]tetrahydrofuran-12-one |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C29H47IO5 |
InChI |
InChI=1S/C29H47IO5/c1-18(2)8-7-9-19(3)23-10-11-24-26-25(13-14-28(23,24)5)29(6,35-27(26)33)15-12-22(34-20(4)31)16-21(32)17-30/h18-19,22-26H,7-17H2,1-6H3/t19?,22?,23?,24?,25?,26?,28-,29+/m1/s1 |
InChIKey |
PVBNJZLGQMRUOK-MPIAFZGXSA-N |
Molecular Weight |
602.594 g/mol |
SMILES |
[C@@]12(C(C3C(O[C@](C3CC2)(CCC(OC(=O)C)CC(=O)CI)C)=O)CCC1C(CCCC(C)C)C)C |
SPLASH |
splash10-0gb9-0079000000-c9d0dc7bb8f2d22f3d65 |
Source of Spectrum |
J-62-2980-25 |
Wiley ID |
1410583 |