| SpectraBase Spectrum ID |
nPj2qwaAVa |
| Name |
(2' S)-5-(Menthyloxy)-4-(1'-isopropylpyrrolidin-2'-yl)-4,5-dihydrofuran-2(3H)-one |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
351.277344052 u |
| Formula |
C21H37NO3 |
| InChI |
InChI=1S/C21H37NO3/c1-13(2)16-9-8-15(5)11-19(16)24-21-17(12-20(23)25-21)18-7-6-10-22(18)14(3)4/h13-19,21H,6-12H2,1-5H3/t15?,16?,17?,18-,19?,21?/m0/s1 |
| InChIKey |
FGMFBLOHGMVPSO-ZLVBVOKDSA-N |
| Molecular Weight |
351.531 g/mol |
| SMILES |
C1(C(OC(C1)=O)OC1C(CCC(C1)C)C(C)C)[C@]1(N(C(C)C)CCC1)[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.875414 |
