| SpectraBase Spectrum ID |
Kze4owroKoA |
| Name |
1-[1-(3,4-Dihydroisoquinolin-1-yl)cyclopropyl]-1-propanone |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
227.131014170 u |
| Formula |
C15H17NO |
| InChI |
InChI=1S/C15H17NO/c1-2-13(17)15(8-9-15)14-12-6-4-3-5-11(12)7-10-16-14/h3-6H,2,7-10H2,1H3 |
| InChIKey |
VPBXNGLSOZQATQ-UHFFFAOYSA-N |
| Molecular Weight |
227.307 g/mol |
| SMILES |
C1(C=2C3=C(C=CC=C3)CCN2)(CC1)C(=O)CC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.879145 |
![1-[1-(3,4-Dihydroisoquinolin-1-yl)cyclopropyl]-1-propanone](/api/spectrum/Kze4owroKoA/structure.png?h=300&w=458 "1-[1-(3,4-Dihydroisoquinolin-1-yl)cyclopropyl]-1-propanone")
