SpectraBase Spectrum ID |
HAqOfpEPXDm |
Name |
1H-Pyrrole, 2,5-dihydro-2,3,4-trimethyl-1-(phenylmethyl)- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
201.151749616 u |
Formula |
C14H19N |
InChI |
InChI=1S/C14H19N/c1-11-9-15(13(3)12(11)2)10-14-7-5-4-6-8-14/h4-8,13H,9-10H2,1-3H3 |
InChIKey |
QEFPXIMIJYFMMC-UHFFFAOYSA-N |
Molecular Weight |
201.313 g/mol |
SMILES |
C1(N(CC(=C1C)C)CC1=CC=CC=C1)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.906514 |