CID 22347155
330792-68-2
Structural Information
- Molecular Formula
- C16H10N2O2
- SMILES
- C1=CC=C(C=C1)OC2=CC=C(C=C2)C(=C(C#N)C#N)O
- InChI
- InChI=1S/C16H10N2O2/c17-10-13(11-18)16(19)12-6-8-15(9-7-12)20-14-4-2-1-3-5-14/h1-9,19H
- InChIKey
- MWTPPIZIKZHMSK-UHFFFAOYSA-N
- Compound name
- 2-[hydroxy-(4-phenoxyphenyl)methylidene]propanedinitrile
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 263.08150 | 176.4 |
[M+Na]+ | 285.06344 | 185.6 |
[M-H]- | 261.06694 | 179.7 |
[M+NH4]+ | 280.10804 | 186.2 |
[M+K]+ | 301.03738 | 179.1 |
[M+H-H2O]+ | 245.07148 | 160.2 |
[M+HCOO]- | 307.07242 | 186.9 |
[M+CH3COO]- | 321.08807 | 221.8 |
[M+Na-2H]- | 283.04889 | 176.2 |
[M]+ | 262.07367 | 167.0 |
[M]- | 262.07477 | 167.0 |