| SpectraBase Spectrum ID |
B6gUCAzsUVt |
| Name |
(1R,2S,3S,5R)-2-(anilinomethyl)-3-ethoxy-6,6-dimethyl-norpinan-2-ol |
| Alternate Name(s) |
(1R,3S,4S,5R)-3-ethoxy-6,6-dimethyl-4-(phenylazanylmethyl)bicyclo[3.1.1]heptan-4-ol
(1R,3S,4S,5R)-4-(anilinomethyl)-3-ethoxy-6,6-dimethyl-4-bicyclo[3.1.1]heptanol
(1R,3S,4S,5R)-4-(anilinomethyl)-3-ethoxy-6,6-dimethylbicyclo[3.1.1]heptan-4-ol |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H27NO2 |
| InChI |
InChI=1S/C18H27NO2/c1-4-21-16-11-13-10-15(17(13,2)3)18(16,20)12-19-14-8-6-5-7-9-14/h5-9,13,15-16,19-20H,4,10-12H2,1-3H3/t13-,15-,16+,18-/m1/s1 |
| InChIKey |
XJPOVUGGVJWKQL-NYCLONFESA-N |
| Molecular Weight |
289.419 g/mol |
| SMILES |
N(C[C@]1([C@]2(C(C)(C)[C@@](C[C@@]1(OCC)[H])(C2)[H])[H])O)c1ccccc1 |
| SPLASH |
splash10-0a4i-0910000000-6cdd8039dc28d72973ca |
| Source of Spectrum |
J-64-3212-10 |
| Wiley ID |
1529991 |
