CID 720601
282104-73-8
Structural Information
- Molecular Formula
- C17H19NO3
- SMILES
- CC1=CC(=C(C=C1)C(C)C)OCC2=CC=C(C=C2)[N+](=O)[O-]
- InChI
- InChI=1S/C17H19NO3/c1-12(2)16-9-4-13(3)10-17(16)21-11-14-5-7-15(8-6-14)18(19)20/h4-10,12H,11H2,1-3H3
- InChIKey
- FDOUPKOYCQGJPR-UHFFFAOYSA-N
- Compound name
- 4-methyl-2-[(4-nitrophenyl)methoxy]-1-propan-2-ylbenzene
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 286.14378 | 165.9 |
[M+Na]+ | 308.12572 | 181.0 |
[M+NH4]+ | 303.17032 | 174.1 |
[M+K]+ | 324.09966 | 176.0 |
[M-H]- | 284.12922 | 171.8 |
[M+Na-2H]- | 306.11117 | 174.1 |
[M]+ | 285.13595 | 169.8 |
[M]- | 285.13705 | 169.8 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.