SpectraBase Spectrum ID |
4F39tsGiXMu |
Name |
2-Isoamyl-3-methylene-2,3-dihydroisoindol-2-one |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
215.131014170 u |
Formula |
C14H17NO |
InChI |
InChI=1S/C14H17NO/c1-10(2)8-9-15-11(3)12-6-4-5-7-13(12)14(15)16/h4-7,10H,3,8-9H2,1-2H3 |
InChIKey |
OOJSIASRBGUFLY-UHFFFAOYSA-N |
Molecular Weight |
215.296 g/mol |
SMILES |
C1(N(C(C=2C=CC=CC12)=C)CCC(C)C)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.92704 |