SpectraBase Spectrum ID |
GRghVLKL119 |
Name |
4-(Dimethylamino)benzoin |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
255.125928789 u |
Formula |
C16H17NO2 |
InChI |
InChI=1S/C16H17NO2/c1-17(2)14-10-8-13(9-11-14)16(19)15(18)12-6-4-3-5-7-12/h3-11,15,18H,1-2H3 |
InChIKey |
SOLBSNQBVLAREX-UHFFFAOYSA-N |
Molecular Weight |
255.317 g/mol |
SMILES |
OC(C(C1=CC=C(C=C1)N(C)C)=O)C=1C=CC=CC1 |
Spectrum/Structure Validation Score (Raman) |
0.766812 |