| SpectraBase Spectrum ID |
8wfXVKN7PPZ |
| Name |
4H-Chromen-4-one, 2,3-dihydro-2,2-dimethyl-7-[2-(1-piperidyl)ethoxy]- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
303.183443666 u |
| Formula |
C18H25NO3 |
| InChI |
InChI=1S/C18H25NO3/c1-18(2)13-16(20)15-7-6-14(12-17(15)22-18)21-11-10-19-8-4-3-5-9-19/h6-7,12H,3-5,8-11,13H2,1-2H3 |
| InChIKey |
ACBJKTYPIRHGJQ-UHFFFAOYSA-N |
| SMILES |
C12=C(C(=O)CC(O2)(C)C)C=CC(=C1)OCCN1CCCCC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.97799 |
![4H-Chromen-4-one, 2,3-dihydro-2,2-dimethyl-7-[2-(1-piperidyl)ethoxy]-](/api/spectrum/8wfXVKN7PPZ/structure.png?h=300&w=458 "4H-Chromen-4-one, 2,3-dihydro-2,2-dimethyl-7-[2-(1-piperidyl)ethoxy]-")
