CID 17534
6-chrysenamine
Structural Information
- Molecular Formula
- C18H13N
- SMILES
- C1=CC=C2C(=C1)C=CC3=C2C=C(C4=CC=CC=C34)N
- InChI
- InChI=1S/C18H13N/c19-18-11-17-13-6-2-1-5-12(13)9-10-15(17)14-7-3-4-8-16(14)18/h1-11H,19H2
- InChIKey
- KIVUHCNVDWYUNP-UHFFFAOYSA-N
- Compound name
- chrysen-6-amine
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 244.11208 | 151.6 |
[M+Na]+ | 266.09402 | 162.2 |
[M-H]- | 242.09752 | 158.1 |
[M+NH4]+ | 261.13862 | 171.8 |
[M+K]+ | 282.06796 | 155.3 |
[M+H-H2O]+ | 226.10206 | 144.0 |
[M+HCOO]- | 288.10300 | 174.2 |
[M+CH3COO]- | 302.11865 | 164.7 |
[M+Na-2H]- | 264.07947 | 162.6 |
[M]+ | 243.10425 | 151.6 |
[M]- | 243.10535 | 151.6 |