CID 2758768
1-ethoxy-4-isocyanobenzene
Structural Information
- Molecular Formula
- C9H9NO
- SMILES
- CCOC1=CC=C(C=C1)[N+]#[C-]
- InChI
- InChI=1S/C9H9NO/c1-3-11-9-6-4-8(10-2)5-7-9/h4-7H,3H2,1H3
- InChIKey
- IHWIBHZFLANVOR-UHFFFAOYSA-N
- Compound name
- 1-ethoxy-4-isocyanobenzene
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 148.07570 | 130.3 |
[M+Na]+ | 170.05764 | 144.7 |
[M+NH4]+ | 165.10224 | 136.6 |
[M+K]+ | 186.03158 | 136.1 |
[M-H]- | 146.06114 | 126.8 |
[M+Na-2H]- | 168.04309 | 135.5 |
[M]+ | 147.06787 | 130.7 |
[M]- | 147.06897 | 130.7 |