CID 112999
Einecs 263-827-8
Structural Information
- Molecular Formula
- C32H34N4O3
- SMILES
- CCN(CC)C1=CC(=C(C=C1)N=C2C=C(C(=O)C3=CC=CC=C32)C(=O)NCCC4=CC=CC=C4NC(=O)C)C
- InChI
- InChI=1S/C32H34N4O3/c1-5-36(6-2)24-15-16-28(21(3)19-24)35-30-20-27(31(38)26-13-9-8-12-25(26)30)32(39)33-18-17-23-11-7-10-14-29(23)34-22(4)37/h7-16,19-20H,5-6,17-18H2,1-4H3,(H,33,39)(H,34,37)
- InChIKey
- XFESIBWPGWHDKC-UHFFFAOYSA-N
- Compound name
- N-[2-(2-acetamidophenyl)ethyl]-4-[4-(diethylamino)-2-methylphenyl]imino-1-oxonaphthalene-2-carboxamide
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 523.27034 | 232.3 |
[M+Na]+ | 545.25228 | 234.7 |
[M-H]- | 521.25578 | 243.9 |
[M+NH4]+ | 540.29688 | 238.4 |
[M+K]+ | 561.22622 | 230.3 |
[M+H-H2O]+ | 505.26032 | 219.5 |
[M+HCOO]- | 567.26126 | 254.6 |
[M+CH3COO]- | 581.27691 | 265.6 |
[M+Na-2H]- | 543.23773 | 230.8 |
[M]+ | 522.26251 | 234.4 |
[M]- | 522.26361 | 234.4 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.