| SpectraBase Spectrum ID |
EKBzrhZYxfi |
| Name |
1-Benzyl 3-[(1R,2S,5R)-2-isopropyl-5-methylcyclohexyl] (2'R/S)-2'-(tert-butyl)malonate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C24H36O4 |
| InChI |
InChI=1S/C24H36O4/c1-16(2)19-13-12-17(3)14-20(19)28-23(26)21(24(4,5)6)22(25)27-15-18-10-8-7-9-11-18/h7-11,16-17,19-21H,12-15H2,1-6H3/t17-,19+,20-,21?/m1/s1 |
| InChIKey |
LWDKASOVHGXPNP-IOTSQUBESA-N |
| Instrument Name |
Finnigan MAT, Varian Saturn II |
| Ionization Type |
EI |
| Literature Reference DOI |
10.3762/bjoc.13.5 |
| Molecular Weight |
388.548 g/mol |
| SMILES |
C1[C@](C[C@]([C@@](C1)(C(C)C)[H])(OC(C(C(=O)OCc1ccccc1)C(C)(C)C)=O)[H])(C)[H] |
| SPLASH |
splash10-0536-9210000000-e7f50c0936322cdf5d72 |
| Source of Spectrum |
BJO-13-SM6-8a/b |
| Wiley ID |
1848335 |
![1-Benzyl 3-[(1R,2S,5R)-2-isopropyl-5-methylcyclohexyl] (2'R/S)-2'-(tert-butyl)malonate](/api/spectrum/EKBzrhZYxfi/structure.png?h=300&w=458 "1-Benzyl 3-[(1R,2S,5R)-2-isopropyl-5-methylcyclohexyl] (2'R/S)-2'-(tert-butyl)malonate")
