CID 14200627
2-methyl-3,4-dihydronaphthalene-1-carboxylic acid
Structural Information
- Molecular Formula
- C12H12O2
- SMILES
- CC1=C(C2=CC=CC=C2CC1)C(=O)O
- InChI
- InChI=1S/C12H12O2/c1-8-6-7-9-4-2-3-5-10(9)11(8)12(13)14/h2-5H,6-7H2,1H3,(H,13,14)
- InChIKey
- IGCVVCHOXDUQMT-UHFFFAOYSA-N
- Compound name
- 2-methyl-3,4-dihydronaphthalene-1-carboxylic acid
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 189.09100 | 138.3 |
[M+Na]+ | 211.07294 | 146.2 |
[M-H]- | 187.07644 | 141.7 |
[M+NH4]+ | 206.11754 | 158.6 |
[M+K]+ | 227.04688 | 143.1 |
[M+H-H2O]+ | 171.08098 | 132.8 |
[M+HCOO]- | 233.08192 | 158.5 |
[M+CH3COO]- | 247.09757 | 181.9 |
[M+Na-2H]- | 209.05839 | 144.2 |
[M]+ | 188.08317 | 137.1 |
[M]- | 188.08427 | 137.1 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.