SpectraBase Spectrum ID |
BgxkX3i8Kme |
Name |
7-Benzyl-15-methyl-1,7,13-triazabicyclo[11.3.1]heptadeca-15-en-14,17-dione |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
369.241627248 u |
Formula |
C22H31N3O2 |
InChI |
InChI=1S/C22H31N3O2/c1-19-17-24-15-9-3-7-13-23(18-20-11-5-2-6-12-20)14-8-4-10-16-25(21(19)26)22(24)27/h2,5-6,11-12,17H,3-4,7-10,13-16,18H2,1H3 |
InChIKey |
KFVGMQLASWDTPH-UHFFFAOYSA-N |
Molecular Weight |
369.509 g/mol |
SMILES |
C1(N2CCCCCN(CCCCCN1C=C(C2=O)C)CC=1C=CC=CC1)=O |