CID 57659685
912846-68-5
Structural Information
- Molecular Formula
- C14H19FN2O2
- SMILES
- CC(C)(C)OC(=O)N1CCC2=CC(=C(C=C2C1)F)N
- InChI
- InChI=1S/C14H19FN2O2/c1-14(2,3)19-13(18)17-5-4-9-7-12(16)11(15)6-10(9)8-17/h6-7H,4-5,8,16H2,1-3H3
- InChIKey
- SKNYBTIRSWCZMQ-UHFFFAOYSA-N
- Compound name
- tert-butyl 6-amino-7-fluoro-3,4-dihydro-1H-isoquinoline-2-carboxylate
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 267.15035 | 162.2 |
[M+Na]+ | 289.13229 | 169.3 |
[M-H]- | 265.13579 | 163.4 |
[M+NH4]+ | 284.17689 | 178.5 |
[M+K]+ | 305.10623 | 166.4 |
[M+H-H2O]+ | 249.14033 | 154.6 |
[M+HCOO]- | 311.14127 | 178.1 |
[M+CH3COO]- | 325.15692 | 200.2 |
[M+Na-2H]- | 287.11774 | 165.2 |
[M]+ | 266.14252 | 159.4 |
[M]- | 266.14362 | 159.4 |
Literature stripe
No literature data available for this compound.