CID 84645479
1781570-26-0
Structural Information
- Molecular Formula
- C13H17BrN2O2
- SMILES
- CC(C)(C)OC(=O)N1CCNC2=C1C=C(C=C2)Br
- InChI
- InChI=1S/C13H17BrN2O2/c1-13(2,3)18-12(17)16-7-6-15-10-5-4-9(14)8-11(10)16/h4-5,8,15H,6-7H2,1-3H3
- InChIKey
- IAFNDCQGIBCFLA-UHFFFAOYSA-N
- Compound name
- tert-butyl 7-bromo-3,4-dihydro-2H-quinoxaline-1-carboxylate
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 313.05461 | 165.8 |
[M+Na]+ | 335.03655 | 175.6 |
[M-H]- | 311.04005 | 168.7 |
[M+NH4]+ | 330.08115 | 182.4 |
[M+K]+ | 351.01049 | 164.2 |
[M+H-H2O]+ | 295.04459 | 165.2 |
[M+HCOO]- | 357.04553 | 178.0 |
[M+CH3COO]- | 371.06118 | 198.5 |
[M+Na-2H]- | 333.02200 | 171.7 |
[M]+ | 312.04678 | 182.6 |
[M]- | 312.04788 | 182.6 |
Literature stripe
No literature data available for this compound.