SpectraBase Spectrum ID |
GMcGot9EVw |
Name |
N-Acetyl-2-phenyl-2-[2'-(2''-piperidyl)ethyl]-4,5,6,7-tetrahydroindane-1,3-dione |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
379.214743795 u |
Formula |
C24H29NO3 |
InChI |
InChI=1S/C24H29NO3/c1-17(26)25-16-8-7-11-19(25)14-15-24(18-9-3-2-4-10-18)22(27)20-12-5-6-13-21(20)23(24)28/h2-4,9-10,19H,5-8,11-16H2,1H3 |
InChIKey |
AMBBGTOZJXDMFR-UHFFFAOYSA-N |
Molecular Weight |
379.500 g/mol |
SMILES |
C1(C(C=2CCCCC2C1=O)=O)(CCC1N(C(=O)C)CCCC1)C1=CC=CC=C1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.957726 |