CID 57541
N-[(furan-2-yl)methyl]aniline
Structural Information
- Molecular Formula
- C11H11NO
- SMILES
- C1=CC=C(C=C1)NCC2=CC=CO2
- InChI
- InChI=1S/C11H11NO/c1-2-5-10(6-3-1)12-9-11-7-4-8-13-11/h1-8,12H,9H2
- InChIKey
- HCYZEVXWZFESIN-UHFFFAOYSA-N
- Compound name
- N-(furan-2-ylmethyl)aniline
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 174.09134 | 134.7 |
[M+Na]+ | 196.07328 | 141.8 |
[M-H]- | 172.07678 | 142.1 |
[M+NH4]+ | 191.11788 | 154.8 |
[M+K]+ | 212.04722 | 140.2 |
[M+H-H2O]+ | 156.08132 | 128.1 |
[M+HCOO]- | 218.08226 | 161.2 |
[M+CH3COO]- | 232.09791 | 179.7 |
[M+Na-2H]- | 194.05873 | 143.2 |
[M]+ | 173.08351 | 134.8 |
[M]- | 173.08461 | 134.8 |