CID 68202
517-45-3
Structural Information
- Molecular Formula
- C26H16O2
- SMILES
- C1=CC=C2C(=C1)C(=C3C4=CC=CC=C4OC5=CC=CC=C53)C6=CC=CC=C6O2
- InChI
- InChI=1S/C26H16O2/c1-5-13-21-17(9-1)25(18-10-2-6-14-22(18)27-21)26-19-11-3-7-15-23(19)28-24-16-8-4-12-20(24)26/h1-16H
- InChIKey
- SXXWAWNPJCEOGD-UHFFFAOYSA-N
- Compound name
- 9-xanthen-9-ylidenexanthene
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 361.12230 | 182.7 |
[M+Na]+ | 383.10424 | 191.1 |
[M-H]- | 359.10774 | 193.2 |
[M+NH4]+ | 378.14884 | 195.5 |
[M+K]+ | 399.07818 | 185.5 |
[M+H-H2O]+ | 343.11228 | 171.1 |
[M+HCOO]- | 405.11322 | 196.8 |
[M+CH3COO]- | 419.12887 | 192.7 |
[M+Na-2H]- | 381.08969 | 191.1 |
[M]+ | 360.11447 | 181.4 |
[M]- | 360.11557 | 181.4 |