| SpectraBase Spectrum ID |
IX7Sb3TMqV7 |
| Name |
1-(1-(Chloromethyl)cyclopropyl)-2,3-dioxo-5,6-dihydropyrrolo[1,2-A]isoquinoline |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
287.071306393 u |
| Formula |
C16H14ClNO2 |
| InChI |
InChI=1S/C16H14ClNO2/c17-9-16(6-7-16)12-13-11-4-2-1-3-10(11)5-8-18(13)15(20)14(12)19/h1-4H,5-9H2 |
| InChIKey |
PPGGKEHAMBDDDT-UHFFFAOYSA-N |
| SMILES |
C1(=C2N(CCC3=C2C=CC=C3)C(C1=O)=O)C1(CC1)CCl |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.847622 |
![1-(1-(Chloromethyl)cyclopropyl)-2,3-dioxo-5,6-dihydropyrrolo[1,2-a]isoquinoline](/api/spectrum/IX7Sb3TMqV7/structure.png?h=300&w=458 "1-(1-(Chloromethyl)cyclopropyl)-2,3-dioxo-5,6-dihydropyrrolo[1,2-a]isoquinoline")
