CID 914006
N-(4-pyridinylmethylene)-1,3-benzodioxol-5-amine monohydrochloride
Structural Information
- Molecular Formula
- C13H10N2O2
- SMILES
- C1OC2=C(O1)C=C(C=C2)N=CC3=CC=NC=C3
- InChI
- InChI=1S/C13H10N2O2/c1-2-12-13(17-9-16-12)7-11(1)15-8-10-3-5-14-6-4-10/h1-8H,9H2
- InChIKey
- LRUCDCZBQUBQED-UHFFFAOYSA-N
- Compound name
- N-(1,3-benzodioxol-5-yl)-1-pyridin-4-ylmethanimine
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 227.08151 | 146.7 |
[M+Na]+ | 249.06345 | 155.2 |
[M-H]- | 225.06695 | 155.6 |
[M+NH4]+ | 244.10805 | 163.7 |
[M+K]+ | 265.03739 | 154.2 |
[M+H-H2O]+ | 209.07149 | 138.8 |
[M+HCOO]- | 271.07243 | 170.6 |
[M+CH3COO]- | 285.08808 | 160.5 |
[M+Na-2H]- | 247.04890 | 156.1 |
[M]+ | 226.07368 | 148.8 |
[M]- | 226.07478 | 148.8 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.