SpectraBase Spectrum ID |
1tZRpQHxNwo |
Name |
(-)-dehydroclausenamide |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
279.125928789 u |
Formula |
C18H17NO2 |
InChI |
InChI=1S/C18H17NO2/c1-19-15-14(12-8-4-2-5-9-12)17(18(19)20)21-16(15)13-10-6-3-7-11-13/h2-11,14-17H,1H3/t14?,15?,16?,17-/m0/s1 |
InChIKey |
QVGJMLNUOQHRAS-GZUIOVLMSA-N |
SMILES |
C1(N(C2C([C@]1([H])OC2C1=CC=CC=C1)C=1C=CC=CC1)C)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.950024 |