CID 3016028
38982-12-6
Structural Information
- Molecular Formula
- C17H12O
- SMILES
- C1=CC=C2C(=C1)C=C3C=CC=CC3=C2C=CC=O
- InChI
- InChI=1S/C17H12O/c18-11-5-10-17-15-8-3-1-6-13(15)12-14-7-2-4-9-16(14)17/h1-12H
- InChIKey
- NLHDGEXLFCDTHQ-UHFFFAOYSA-N
- Compound name
- 3-anthracen-9-ylprop-2-enal
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 233.09610 | 149.5 |
[M+Na]+ | 255.07804 | 159.8 |
[M-H]- | 231.08154 | 155.3 |
[M+NH4]+ | 250.12264 | 169.7 |
[M+K]+ | 271.05198 | 153.5 |
[M+H-H2O]+ | 215.08608 | 142.5 |
[M+HCOO]- | 277.08702 | 173.1 |
[M+CH3COO]- | 291.10267 | 163.1 |
[M+Na-2H]- | 253.06349 | 159.3 |
[M]+ | 232.08827 | 151.7 |
[M]- | 232.08937 | 151.7 |