CID 101159107
(z)-n-[2-(5-hydroxy-1h-indol-3-yl)ethyl]docos-13-enamide
Structural Information
- Molecular Formula
- C32H52N2O2
- SMILES
- CCCCCCCC/C=C\CCCCCCCCCCCC(=O)NCCC1=CNC2=C1C=C(C=C2)O
- InChI
- InChI=1S/C32H52N2O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-32(36)33-25-24-28-27-34-31-23-22-29(35)26-30(28)31/h9-10,22-23,26-27,34-35H,2-8,11-21,24-25H2,1H3,(H,33,36)/b10-9-
- InChIKey
- ABYYCAVICKVDQH-KTKRTIGZSA-N
- Compound name
- (Z)-N-[2-(5-hydroxy-1H-indol-3-yl)ethyl]docos-13-enamide
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 497.41018 | 235.1 |
[M+Na]+ | 519.39212 | 234.7 |
[M-H]- | 495.39562 | 232.3 |
[M+NH4]+ | 514.43672 | 242.0 |
[M+K]+ | 535.36606 | 225.3 |
[M+H-H2O]+ | 479.40016 | 224.9 |
[M+HCOO]- | 541.40110 | 250.2 |
[M+CH3COO]- | 555.41675 | 243.5 |
[M+Na-2H]- | 517.37757 | 229.8 |
[M]+ | 496.40235 | 241.3 |
[M]- | 496.40345 | 241.3 |
Literature stripe
Patent stripe
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