CID 74645
N-aminophthalimide
Structural Information
- Molecular Formula
- C8H6N2O2
- SMILES
- C1=CC=C2C(=C1)C(=O)N(C2=O)N
- InChI
- InChI=1S/C8H6N2O2/c9-10-7(11)5-3-1-2-4-6(5)8(10)12/h1-4H,9H2
- InChIKey
- KSILMCDYDAKOJD-UHFFFAOYSA-N
- Compound name
- 2-aminoisoindole-1,3-dione
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 163.05020 | 128.9 |
[M+Na]+ | 185.03214 | 139.6 |
[M-H]- | 161.03564 | 132.7 |
[M+NH4]+ | 180.07674 | 151.2 |
[M+K]+ | 201.00608 | 136.8 |
[M+H-H2O]+ | 145.04018 | 123.3 |
[M+HCOO]- | 207.04112 | 153.0 |
[M+CH3COO]- | 221.05677 | 178.6 |
[M+Na-2H]- | 183.01759 | 134.8 |
[M]+ | 162.04237 | 128.1 |
[M]- | 162.04347 | 128.1 |