SpectraBase Spectrum ID |
JMTAt5tTqBO |
Name |
Spiro[cycloheptane-1,3'-[3H]indole]-1'(2'H)-propanamide, N,N-dimethyl-2'-phenyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
376.251463657 u |
Formula |
C25H32N2O |
InChI |
InChI=1S/C25H32N2O/c1-26(2)23(28)16-19-27-22-15-9-8-14-21(22)25(17-10-3-4-11-18-25)24(27)20-12-6-5-7-13-20/h5-9,12-15,24H,3-4,10-11,16-19H2,1-2H3 |
InChIKey |
BRNZUBCUTFZSQW-UHFFFAOYSA-N |
Molecular Weight |
376.544 g/mol |
SMILES |
C1(N(C2=C(C11CCCCCC1)C=CC=C2)CCC(N(C)C)=O)C=1C=CC=CC1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.874421 |