CID 20112800
3-methyl-2-[2-(naphthalen-2-yl)acetamido]butanoic acid
Structural Information
- Molecular Formula
- C17H19NO3
- SMILES
- CC(C)C(C(=O)O)NC(=O)CC1=CC2=CC=CC=C2C=C1
- InChI
- InChI=1S/C17H19NO3/c1-11(2)16(17(20)21)18-15(19)10-12-7-8-13-5-3-4-6-14(13)9-12/h3-9,11,16H,10H2,1-2H3,(H,18,19)(H,20,21)
- InChIKey
- KYYXUCOBOBVOGO-UHFFFAOYSA-N
- Compound name
- 3-methyl-2-[(2-naphthalen-2-ylacetyl)amino]butanoic acid
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 286.14378 | 166.6 |
[M+Na]+ | 308.12572 | 176.7 |
[M+NH4]+ | 303.17032 | 173.2 |
[M+K]+ | 324.09966 | 171.8 |
[M-H]- | 284.12922 | 167.9 |
[M+Na-2H]- | 306.11117 | 170.7 |
[M]+ | 285.13595 | 168.1 |
[M]- | 285.13705 | 168.1 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.