| SpectraBase Compound ID | G21TYTwpZB3 |
|---|---|
| InChI | InChI=1S/C21H28O5/c1-14(2)15-7-9-16-6-5-13-21(3,26-20(16)24)18(22)12-11-17(10-8-15)19(23)25-4/h6,8,10,14H,5,7,9,11-13H2,1-4H3/b15-8+,17-10+ |
| InChIKey | SSRWHVBVQPAITB-SOWNIVKUSA-N |
| Mol Weight | 360.45 g/mol |
| Molecular Formula | C21H28O5 |
| Exact Mass | 360.193674 g/mol |
Mass Spectrum (GC)
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 6MVbFAVRAsI |
|---|---|
| Name | Ketoemblide |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C21H28O5 |
| InChI | InChI=1S/C21H28O5/c1-14(2)15-7-9-16-6-5-13-21(3,26-20(16)24)18(22)12-11-17(10-8-15)19(23)25-4/h6,8,10,14H,5,7,9,11-13H2,1-4H3/b15-8+,17-10+ |
| InChIKey | SSRWHVBVQPAITB-SOWNIVKUSA-N |
| Ionization Type | EI-B |
| Molecular Weight | 360.450 g/mol |
| SMILES | COC(=O)\C1=C\C=C/(CCC=2C(OC(C(CC1)=O)(C)CCC2)=O)C(C)C |
| SPLASH | splash10-001u-9210000000-d5019eeb38c93ddd5d51 |
| Source of Spectrum | SRH-2022-10840-0 |
| Wiley ID | 1832449 |