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This information is based on the molecular structure shown on the left side. For a decoupled sample, please refer to its individual details.
Formula: C49H37N5
Canonical SMILES: CC1(C)c2ccccc2N(c2c1cccc2)c1ccc2c(c1)c1cc(ccc1c1c2nc2ncccc2n1)N1c2ccccc2C(c2c1cccc2)(C)C
InChI: InChI=1S/C49H37N5/c1-48(2)36-14-5-9-19-41(36)53(42-20-10-6-15-37(42)48)30-23-25-32-34(28-30)35-29-31(24-26-33(35)46-45(32)51-40-18-13-27-50-47(40)52-46)54-43-21-11-7-16-38(43)49(3,4)39-17-8-12-22-44(39)54/h5-29H,1-4H3
InChIKey: YUGQZLIRQPRKQH-UHFFFAOYSA-N
Exact Mass:
Crosslinks: 
Published on 2024-11-25
heteronuclear single quantum coherence (HSQC)
Author: 
Jason Hofmann1
1. Institute of Organic Chemistry, Karlsruher Institute of Technology, Germany
Analysis DOI:
Analysis ID:
Datasets