CID 3072333
Brn 4312627
Structural Information
- Molecular Formula
- C14H21NO2
- SMILES
- CN(CCCC(=O)CC1=CC=CC=C1)CCO
- InChI
- InChI=1S/C14H21NO2/c1-15(10-11-16)9-5-8-14(17)12-13-6-3-2-4-7-13/h2-4,6-7,16H,5,8-12H2,1H3
- InChIKey
- QQBITNLFHAVPFO-UHFFFAOYSA-N
- Compound name
- 5-[2-hydroxyethyl(methyl)amino]-1-phenylpentan-2-one
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 236.16451 | 157.3 |
[M+Na]+ | 258.14645 | 161.4 |
[M-H]- | 234.14995 | 160.0 |
[M+NH4]+ | 253.19105 | 174.5 |
[M+K]+ | 274.12039 | 159.6 |
[M+H-H2O]+ | 218.15449 | 150.2 |
[M+HCOO]- | 280.15543 | 179.9 |
[M+CH3COO]- | 294.17108 | 196.1 |
[M+Na-2H]- | 256.13190 | 160.6 |
[M]+ | 235.15668 | 159.2 |
[M]- | 235.15778 | 159.2 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.