CID 5458879
N-(p-coumaroyl) serotonin
Structural Information
- Molecular Formula
- C19H18N2O3
- SMILES
- C1=CC(=CC=C1/C=C/C(=O)NCCC2=CNC3=C2C=C(C=C3)O)O
- InChI
- InChI=1S/C19H18N2O3/c22-15-4-1-13(2-5-15)3-8-19(24)20-10-9-14-12-21-18-7-6-16(23)11-17(14)18/h1-8,11-12,21-23H,9-10H2,(H,20,24)/b8-3+
- InChIKey
- WLZPAFGVOWCVMG-FPYGCLRLSA-N
- Compound name
- (E)-N-[2-(5-hydroxy-1H-indol-3-yl)ethyl]-3-(4-hydroxyphenyl)prop-2-enamide
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 323.13902 | 174.8 |
[M+Na]+ | 345.12096 | 182.1 |
[M-H]- | 321.12446 | 177.8 |
[M+NH4]+ | 340.16556 | 188.2 |
[M+K]+ | 361.09490 | 174.9 |
[M+H-H2O]+ | 305.12900 | 167.1 |
[M+HCOO]- | 367.12994 | 194.7 |
[M+CH3COO]- | 381.14559 | 202.5 |
[M+Na-2H]- | 343.10641 | 177.8 |
[M]+ | 322.13119 | 174.3 |
[M]- | 322.13229 | 174.3 |