CID 5357650
N-trans-cinnamoylimidazole
Structural Information
- Molecular Formula
- C12H10N2O
- SMILES
- C1=CC=C(C=C1)/C=C/C(=O)N2C=CN=C2
- InChI
- InChI=1S/C12H10N2O/c15-12(14-9-8-13-10-14)7-6-11-4-2-1-3-5-11/h1-10H/b7-6+
- InChIKey
- XVGXMXZUJNAGFZ-VOTSOKGWSA-N
- Compound name
- (E)-1-imidazol-1-yl-3-phenylprop-2-en-1-one
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 199.08660 | 143.1 |
[M+Na]+ | 221.06854 | 151.0 |
[M-H]- | 197.07204 | 147.1 |
[M+NH4]+ | 216.11314 | 161.0 |
[M+K]+ | 237.04248 | 147.3 |
[M+H-H2O]+ | 181.07658 | 134.7 |
[M+HCOO]- | 243.07752 | 166.0 |
[M+CH3COO]- | 257.09317 | 181.2 |
[M+Na-2H]- | 219.05399 | 148.4 |
[M]+ | 198.07877 | 142.5 |
[M]- | 198.07987 | 142.5 |