| SpectraBase Spectrum ID |
6K8LWwlSUSp |
| Name |
Methyl (1R.3aR)-1-(3'-nitrobenzyl)-1,6,6-trimethylhexahydroindene-3a-carboxylate |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H27NO4 |
| InChI |
InChI=1S/C21H27NO4/c1-19(2)8-10-21(18(23)26-4)11-9-20(3,17(21)14-19)13-15-6-5-7-16(12-15)22(24)25/h5-7,12,14H,8-11,13H2,1-4H3/t20-,21-/m1/s1 |
| InChIKey |
UVCJZLIIMQKGPB-NHCUHLMSSA-N |
| Molecular Weight |
357.450 g/mol |
| SMILES |
C=12[C@](C(=O)OC)(CC[C@@]2(Cc2cc(N(=O)=O)ccc2)C)CCC(C1)(C)C |
| SPLASH |
splash10-03k9-0950000000-05b6fd8ed4d7fba8277b |
| Source of Spectrum |
F-53-11824-48 |
| Synonyms |
Methyl (1R,3aR)-1,6,6-trimethyl-1-(3-nitrobenzyl)-1,2,3,4,5,6-hexahydro-3aH-indene-3a-carboxylate
Methyl 1-(3'-nitrobenzyl)-1,6,6-trimethylhexahydroindene-3a-carboxylate |
| Wiley ID |
803365 |
