| SpectraBase Spectrum ID |
7sXtF7uSIqF |
| Name |
(1R,2R,3S,5R)-3-[3-((R)-Nitromethyl)-1-oxobutyloxy]-2,6,6-trimethylbicyclo[3.1.1]heptane-2-ol |
| Alternate Name(s) |
(1R,2R,3S,5R)-2-hydroxy-2,6,6-trimethylbicyclo[3.1.1]hept-3-yl (3R)-3-methyl-4-nitrobutanoate
3-[3-(Nitromethyl)-1-oxobutyloxy]-1,7,7-trimethylbicyclo[3.1.1]heptane-1-ol |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C15H25NO5 |
| InChI |
InChI=1S/C15H25NO5/c1-9(8-16(19)20)5-13(17)21-12-7-10-6-11(14(10,2)3)15(12,4)18/h9-12,18H,5-8H2,1-4H3/t9-,10-,11-,12+,15-/m1/s1 |
| InChIKey |
XVXWWKWJZFPZCS-XRHZXQNYSA-N |
| Molecular Weight |
299.367 g/mol |
| SMILES |
O[C@@]1([C@]2(C(C)(C)[C@](C2)(C[C@@]1(OC(=O)C[C@](CN(=O)=O)(C)[H])[H])[H])[H])C |
| SPLASH |
splash10-0002-9300000000-785666fc0094275ade50 |
| Source of Spectrum |
KD-13-2516-2 |
| Wiley ID |
1635587 |
![(1R,2R,3S,5R)-3-[3-((R)-Nitromethyl)-1-oxobutyloxy]-2,6,6-trimethylbicyclo[3.1.1]heptane-2-ol](/api/spectrum/7sXtF7uSIqF/structure.png?h=300&w=458 "(1R,2R,3S,5R)-3-[3-((R)-Nitromethyl)-1-oxobutyloxy]-2,6,6-trimethylbicyclo[3.1.1]heptane-2-ol")
