SpectraBase Spectrum ID |
Bqjm5wk2mIE |
Name |
7,14-Methano-6H,13H-dipyrido[1,2-A:1',2'-E][1,5]diazocine-6,13-dione, dodecahydro-, [7R-(7.alpha.,7A.alpha.,14.alpha.,14A.beta.)]- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
262.168127954 u |
Formula |
C15H22N2O2 |
InChI |
InChI=1S/C15H22N2O2/c18-14-10-9-11(13-6-2-4-8-17(13)14)15(19)16-7-3-1-5-12(10)16/h10-13H,1-9H2/t10-,11-,12-,13+/m1/s1 |
InChIKey |
BUJFCCGYEMOGKQ-LPWJVIDDSA-N |
Molecular Weight |
262.353 g/mol |
SMILES |
C1(=O)[C@]2([C@]3(N(C([C@](C2)([C@@]2(N1CCCC2)[H])[H])=O)CCCC3)[H])[H] |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.983835 |