(1S,3R,7S,9aR)-1,4,7-Trimethyl-3-(2-methylprop-1-en-1-yl)-2,3,7,8,9,9a-hexahydro-1-phenalen-5-yl trifluoromethanesulfonate
Compound with spectra: 1 MS (GC)
| SpectraBase Compound ID | J0GEzY7NCZj |
|---|---|
| InChI | InChI=1S/C21H27F3O3S/c1-11(2)8-15-9-13(4)16-7-6-12(3)17-10-18(14(5)19(15)20(16)17)27-28(25,26)21(22,23)24/h8,10,12-13,15-16H,6-7,9H2,1-5H3/t12-,13-,15-,16+/m0/s1 |
| InChIKey | QKWFBCSEAMDDSJ-DARAHFNDSA-N |
| Mol Weight | 416.5 g/mol |
| Molecular Formula | C21H27F3O3S |
| Exact Mass | 416.1633 g/mol |
| Enantiomer InChIKey | QKWFBCSEAMDDSJ-XOUADPBQSA-N |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Spectrum | K1-2022-SM66-SI-16 (DOI: 10.1002/ejoc.202200058) |
2-(((1S,3R,7S,9aR)-1,4,7-Trimethyl-3-(2-methylprop-1-en-1-yl)-2,3,7,8,9,9a-hexahydro-1-phenalen-5-yl)oxy)acetamide
(1R,3S,6R,13R)-7,8-Dimethoxy-3,6,9-trimethyl-1-(2-methylprop-1-enyl)-2,3,3a,4,5,6-hexahydro-1H-phenalene
HQCHVIKMXQTAFF-UHFFFAOYSA-N
3-(7-Isocyano-1,1-dimethylheptyl)-6-methyl-6-[3-(tert-butyldimethylsiloxy)propynyl]-9,9-dimethoxy-6a,7,8,9,10,10a-hexahydrobenzo[b]chroman-1-ol
2-[(1aR,1bR,5aR,6aR)-1b,5-dimethyl-6-oxidanylidene-1a,2,3,5a-tetrahydro-1H-cyclopropa[a]inden-6a-yl]propan-2-yl ethanoate
5-(3-Acetyl-1-methyl-2-indolizinyl)-4-methoxy-2,5-dihydro-2-furanone
ZYGGOMPHIC_ACID_B
CJDAQYYUMARVPS-UHFFFAOYSA-N
11-Hydroxy-tetrahydrocannabinol-D3 2TMS
1,2,6,7-TETRAHYDROXY-5H-DIBENZO-[A,D]-CYCLOHEPTENE-5-METHYL-11-CARBOXYLIC-ACID
This compound is available in the following databases:
Wiley Registry of Mass Spectral Data 2023
Author: Wiley
The foundation library for any analytical laboratory running mass spectrometry, the Wiley Registry provides the broadest coverage available in any mass spectral library Learn more.