| SpectraBase Spectrum ID |
2AvlAyLuNUc |
| Name |
dimethyl(1.alpha.,2.beta.,5.beta.,6.alpha.)-9-methyl-9-phenyl-3,4,7,8-tetraazatricyclo[4.3.0.0(2,5)non-7-ene-3,4-dicarboxylate |
| CAS Registry Number |
105252-63-9 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H18N4O4 |
| InChI |
InChI=1S/C16H18N4O4/c1-16(9-7-5-4-6-8-9)10-11(17-18-16)13-12(10)19(14(21)23-2)20(13)15(22)24-3/h4-8,10-13H,1-3H3/t10-,11+,12+,13-,16?/m0/s1 |
| InChIKey |
SOHMEQFXTMOUQP-RXEZNISESA-N |
| Molecular Weight |
330.344 g/mol |
| SMILES |
C(N1N([C@@]2([C@]1([C@@]1([C@]2(N=NC1(c1ccccc1)C)[H])[H])[H])[H])C(=O)OC)(=O)OC |
| SPLASH |
splash10-0udi-0009000000-54312d4620980a626399 |
| Source of Spectrum |
K-120-206-10 |
| Synonyms |
dimethyl (1R,2R,5R,6R)-9-methyl-9-phenyl-3,4,7,8-tetraazatricyclo[4.3.0.0(2,5)]non-7-ene-3,4-dicarboxylate |
| Wiley ID |
1327626 |
