| SpectraBase Spectrum ID |
GC8SstW8KqI |
| Name |
rac-N-Cyanomethyl-2-(3,4-dimethoxyphenyl)-2-(3-oxobutyl)- pyrrolidin-3-one |
| Appearance |
Red-brown oil |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H22N2O4 |
| InChI |
InChI=1S/C18H22N2O4/c1-13(21)6-8-18(17(22)7-10-20(18)11-9-19)14-4-5-15(23-2)16(12-14)24-3/h4-5,12H,6-8,10-11H2,1-3H3 |
| InChIKey |
OTJAPOHLIXYKOM-UHFFFAOYSA-N |
| Instrument Name |
Thermo Finnigan TSQ 700 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/ejoc.201801479 |
| Molecular Weight |
330.384 g/mol |
| Reported Formula |
C18H22N2O4 |
| SMILES |
C(#N)CN1C(C(CC1)=O)(CCC(C)=O)c1cc(c(cc1)OC)OC |
| SPLASH |
splash10-0ik9-2941000000-75f21890a86652e27c1d |
| Source of Spectrum |
U1-2019-145-18 |
| Wiley ID |
1843580 |
