| SpectraBase Spectrum ID |
Jj76xFBYgsG |
| Name |
Methyl 4-{3'.beta.-[(benzyloxycarbonyl)amino]-2',2'-dimethyl-5'-oxocyclohex-1'.alpha.-yl]but-2-enoate |
| Alternate Name(s) |
Methyl (2E)-4-((1S,3S)-3-{[(benzyloxy)carbonyl]amino}-2,2-dimethyl-5-oxocyclohexyl)-2-butenoate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H27NO5 |
| InChI |
InChI=1S/C21H27NO5/c1-21(2)16(10-7-11-19(24)26-3)12-17(23)13-18(21)22-20(25)27-14-15-8-5-4-6-9-15/h4-9,11,16,18H,10,12-14H2,1-3H3,(H,22,25)/b11-7+/t16-,18-/m0/s1 |
| InChIKey |
PJPNHHMLEUMMQE-QPXZKVABSA-N |
| Molecular Weight |
373.449 g/mol |
| SMILES |
N(C(=O)OCc1ccccc1)[C@@]1(C([C@@](C\C=C\C(=O)OC)(CC(C1)=O)[H])(C)C)[H] |
| SPLASH |
splash10-05mk-9003000000-59994ad04c3871646d1c |
| Source of Spectrum |
I-78-930-9 |
| Wiley ID |
812711 |
![Methyl 4-{3'.beta.-[(benzyloxycarbonyl)amino]-2',2'-dimethyl-5'-oxocyclohex-1'.alpha.-yl]but-2-enoate](/api/spectrum/Jj76xFBYgsG/structure.png?h=300&w=458 "Methyl 4-{3'.beta.-[(benzyloxycarbonyl)amino]-2',2'-dimethyl-5'-oxocyclohex-1'.alpha.-yl]but-2-enoate")
