CID 52644091
1330170-43-8
Structural Information
- Molecular Formula
- C8H14N2O
- SMILES
- CN1C[C@@H]2CC[C@@H](N2)CC1=O
- InChI
- InChI=1S/C8H14N2O/c1-10-5-7-3-2-6(9-7)4-8(10)11/h6-7,9H,2-5H2,1H3/t6-,7+/m1/s1
- InChIKey
- QKAKLAFGBZQMLX-RQJHMYQMSA-N
- Compound name
- (1S,6R)-3-methyl-3,9-diazabicyclo[4.2.1]nonan-4-one
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 155.11789 | 131.1 |
[M+Na]+ | 177.09983 | 136.9 |
[M-H]- | 153.10333 | 131.2 |
[M+NH4]+ | 172.14443 | 151.0 |
[M+K]+ | 193.07377 | 137.4 |
[M+H-H2O]+ | 137.10787 | 124.9 |
[M+HCOO]- | 199.10881 | 146.5 |
[M+CH3COO]- | 213.12446 | 142.6 |
[M+Na-2H]- | 175.08528 | 135.2 |
[M]+ | 154.11006 | 124.1 |
[M]- | 154.11116 | 124.1 |
Literature stripe
No literature data available for this compound.