| SpectraBase Spectrum ID |
3YTger1HI4P |
| Name |
Endo-5-methoxy-3-patchoulene |
| Alternate Name(s) |
(3aR,4R,7R,8S)-8-methoxy-1,4,9,9-tetramethyl-2,4,5,6,7,8-hexahydro-3H-3a,7-methanoazulene |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H26O |
| InChI |
InChI=1S/C16H26O/c1-10-8-9-16-11(2)6-7-12(15(16,3)4)14(17-5)13(10)16/h11-12,14H,6-9H2,1-5H3/t11-,12-,14+,16+/m1/s1 |
| InChIKey |
JMZYPGXSFGKKLR-HLSYRSCKSA-N |
| Literature Reference DOI |
10.1002/pca.2369 |
| Molecular Weight |
234.383 g/mol |
| SMILES |
C1[C@]23C(=C(C1)C)[C@]([C@@](CC[C@]3(C)[H])(C2(C)C)[H])(OC)[H] |
| SPLASH |
splash10-0a4m-6910000000-32f17f21ca73b31d5ed5 |
| Source of Spectrum |
PA-23-653-C |
| Wiley ID |
1787662 |
