SpectraBase Spectrum ID |
JyKISb1CIwy |
Name |
4'-Methyl-3-(1-pyrrolidinyl)propiophenone |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
217.146664235 u |
Formula |
C14H19NO |
InChI |
InChI=1S/C14H19NO/c1-12-4-6-13(7-5-12)14(16)8-11-15-9-2-3-10-15/h4-7H,2-3,8-11H2,1H3 |
InChIKey |
KKCZPVROBRXZKM-UHFFFAOYSA-N |
Molecular Weight |
217.312 g/mol |
SMILES |
C=1C(=CC=C(C1)C)C(CCN1CCCC1)=O |
Spectrum/Structure Validation Score (Raman) |
0.956963 |