SpectraBase Spectrum ID |
FPPPXHXnJvn |
Name |
Dibenzo[C,E]azocin-1-ol, 2-methoxy-6-methyl-5,6,7,8-tetrahydro- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
269.141578854 u |
Formula |
C17H19NO2 |
InChI |
InChI=1S/C17H19NO2/c1-18-10-9-12-5-3-4-6-14(12)16-13(11-18)7-8-15(20-2)17(16)19/h3-8,19H,9-11H2,1-2H3 |
InChIKey |
ZGZXDJPQXTUPSG-UHFFFAOYSA-N |
SMILES |
C12=C(CN(CCC3=C2C=CC=C3)C)C=CC(=C1O)OC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.830669 |