CID 115523350
1909326-09-5
Structural Information
- Molecular Formula
- C12H17NO2
- SMILES
- CC1=CC(=CC(=C1CC(=O)O)C)N(C)C
- InChI
- InChI=1S/C12H17NO2/c1-8-5-10(13(3)4)6-9(2)11(8)7-12(14)15/h5-6H,7H2,1-4H3,(H,14,15)
- InChIKey
- XAZOGGQSYUTPDR-UHFFFAOYSA-N
- Compound name
- 2-[4-(dimethylamino)-2,6-dimethylphenyl]acetic acid
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 208.13321 | 145.8 |
[M+Na]+ | 230.11515 | 153.6 |
[M-H]- | 206.11865 | 150.1 |
[M+NH4]+ | 225.15975 | 165.1 |
[M+K]+ | 246.08909 | 152.5 |
[M+H-H2O]+ | 190.12319 | 139.9 |
[M+HCOO]- | 252.12413 | 169.0 |
[M+CH3COO]- | 266.13978 | 193.7 |
[M+Na-2H]- | 228.10060 | 148.2 |
[M]+ | 207.12538 | 148.1 |
[M]- | 207.12648 | 148.1 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.