SpectraBase Spectrum ID |
CMqBMPRVj4f |
Name |
1,1,3,3,6,7-Hexamethyl-2,3,3A,4,9,9A-hexahydro-1H-cyclopenta[B]quinoxaline |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
258.209598845 u |
Formula |
C17H26N2 |
InChI |
InChI=1S/C17H26N2/c1-10-7-12-13(8-11(10)2)19-15-14(18-12)16(3,4)9-17(15,5)6/h7-8,14-15,18-19H,9H2,1-6H3 |
InChIKey |
PYEWJLMUHJDUBJ-UHFFFAOYSA-N |
Molecular Weight |
258.409 g/mol |
SMILES |
C12NC3=C(NC2C(C)(C)CC1(C)C)C=C(C(=C3)C)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.814972 |