CID 459270
1-(dodecylamino)anthracene-9,10-dione
Structural Information
- Molecular Formula
- C26H33NO2
- SMILES
- CCCCCCCCCCCCNC1=CC=CC2=C1C(=O)C3=CC=CC=C3C2=O
- InChI
- InChI=1S/C26H33NO2/c1-2-3-4-5-6-7-8-9-10-13-19-27-23-18-14-17-22-24(23)26(29)21-16-12-11-15-20(21)25(22)28/h11-12,14-18,27H,2-10,13,19H2,1H3
- InChIKey
- RPAYWEKSUYVFBC-UHFFFAOYSA-N
- Compound name
- 1-(dodecylamino)anthracene-9,10-dione
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 392.25841 | 199.4 |
[M+Na]+ | 414.24035 | 204.0 |
[M-H]- | 390.24385 | 202.9 |
[M+NH4]+ | 409.28495 | 212.6 |
[M+K]+ | 430.21429 | 196.9 |
[M+H-H2O]+ | 374.24839 | 190.1 |
[M+HCOO]- | 436.24933 | 217.8 |
[M+CH3COO]- | 450.26498 | 229.7 |
[M+Na-2H]- | 412.22580 | 201.2 |
[M]+ | 391.25058 | 203.2 |
[M]- | 391.25168 | 203.2 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.