CID 995
Phenanthrene
Structural Information
- Molecular Formula
- C14H10
- SMILES
- C1=CC=C2C(=C1)C=CC3=CC=CC=C32
- InChI
- InChI=1S/C14H10/c1-3-7-13-11(5-1)9-10-12-6-2-4-8-14(12)13/h1-10H
- InChIKey
- YNPNZTXNASCQKK-UHFFFAOYSA-N
- Compound name
- phenanthrene
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 179.08553 | 134.7 |
[M+Na]+ | 201.06747 | 153.1 |
[M+NH4]+ | 196.11207 | 147.0 |
[M+K]+ | 217.04141 | 142.7 |
[M-H]- | 177.07097 | 140.8 |
[M+Na-2H]- | 199.05292 | 146.1 |
[M]+ | 178.07770 | 139.5 |
[M]- | 178.07880 | 139.5 |