CID 4719552
893590-94-8
Structural Information
- Molecular Formula
- C10H12N2O2
- SMILES
- C=CCNCC1=CC(=CC=C1)[N+](=O)[O-]
- InChI
- InChI=1S/C10H12N2O2/c1-2-6-11-8-9-4-3-5-10(7-9)12(13)14/h2-5,7,11H,1,6,8H2
- InChIKey
- SRSCWMYGQQRHPY-UHFFFAOYSA-N
- Compound name
- N-[(3-nitrophenyl)methyl]prop-2-en-1-amine
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 193.09715 | 140.4 |
[M+Na]+ | 215.07909 | 146.6 |
[M-H]- | 191.08259 | 144.0 |
[M+NH4]+ | 210.12369 | 158.8 |
[M+K]+ | 231.05303 | 140.0 |
[M+H-H2O]+ | 175.08713 | 138.7 |
[M+HCOO]- | 237.08807 | 167.0 |
[M+CH3COO]- | 251.10372 | 180.6 |
[M+Na-2H]- | 213.06454 | 148.4 |
[M]+ | 192.08932 | 138.5 |
[M]- | 192.09042 | 138.5 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.