| SpectraBase Compound ID | dTlzU9ZmXs |
|---|---|
| InChI | InChI=1S/C32H50O6/c1-20-9-10-26-32(18-13-24(35)28(5,6)38-26)19-31(20,32)17-11-22-29(7)15-12-23(34)27(3,4)37-25(29)14-16-30(22,8)36-21(2)33/h20,22,25-26H,9-19H2,1-8H3/t20-,22+,25+,26+,29+,30-,31-,32+/m1/s1 |
| InChIKey | YWFWGDOACPBQBC-DEMPQMHLSA-N |
| Mol Weight | 530.7 g/mol |
| Molecular Formula | C32H50O6 |
| Exact Mass | 530.360739 g/mol |
Vapor Phase (Gas) Infrared Spectrum
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 7qeQOMHCcmK |
|---|---|
| Name | Raspacionin-B |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 530.360739324 u |
| Formula | C32H50O6 |
| InChI | InChI=1S/C32H50O6/c1-20-9-10-26-32(18-13-24(35)28(5,6)38-26)19-31(20,32)17-11-22-29(7)15-12-23(34)27(3,4)37-25(29)14-16-30(22,8)36-21(2)33/h20,22,25-26H,9-19H2,1-8H3/t20-,22+,25+,26+,29+,30-,31-,32+/m1/s1 |
| InChIKey | YWFWGDOACPBQBC-DEMPQMHLSA-N |
| Molecular Weight | 530.746 g/mol |
| SMILES | [C@@]12(OC(C(CC[C@@]22[C@@](CC[C@]3([C@]4([C@](OC(C)(C)C(CC4)=O)([H])CC[C@]3(OC(=O)C)C)C)[H])([C@](C)(CC1)[H])C2)=O)(C)C)[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.962486 |