CID 21850242
6-isopropylindole-3-carboxaldehyde
Structural Information
- Molecular Formula
- C12H13NO
- SMILES
- CC(C)C1=CC2=C(C=C1)C(=CN2)C=O
- InChI
- InChI=1S/C12H13NO/c1-8(2)9-3-4-11-10(7-14)6-13-12(11)5-9/h3-8,13H,1-2H3
- InChIKey
- KAJUTJHDGBYGSL-UHFFFAOYSA-N
- Compound name
- 6-propan-2-yl-1H-indole-3-carbaldehyde
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 188.10700 | 140.1 |
[M+Na]+ | 210.08894 | 153.6 |
[M+NH4]+ | 205.13354 | 148.9 |
[M+K]+ | 226.06288 | 148.6 |
[M-H]- | 186.09244 | 141.7 |
[M+Na-2H]- | 208.07439 | 146.2 |
[M]+ | 187.09917 | 142.5 |
[M]- | 187.10027 | 142.5 |
Literature stripe
No literature data available for this compound.