CID 4570375
2-bromo-4-ethoxy-5-methoxybenzonitrile
Structural Information
- Molecular Formula
- C10H10BrNO2
- SMILES
- CCOC1=C(C=C(C(=C1)Br)C#N)OC
- InChI
- InChI=1S/C10H10BrNO2/c1-3-14-10-5-8(11)7(6-12)4-9(10)13-2/h4-5H,3H2,1-2H3
- InChIKey
- DQVRTBPRKJRONY-UHFFFAOYSA-N
- Compound name
- 2-bromo-4-ethoxy-5-methoxybenzonitrile
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 255.99677 | 140.7 |
[M+Na]+ | 277.97871 | 155.1 |
[M-H]- | 253.98221 | 145.8 |
[M+NH4]+ | 273.02331 | 159.9 |
[M+K]+ | 293.95265 | 144.3 |
[M+H-H2O]+ | 237.98675 | 134.1 |
[M+HCOO]- | 299.98769 | 161.6 |
[M+CH3COO]- | 314.00334 | 203.6 |
[M+Na-2H]- | 275.96416 | 147.2 |
[M]+ | 254.98894 | 156.2 |
[M]- | 254.99004 | 156.2 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.