CID 6448846
6-(1-oxo-3-(2-thienyl)-2-propenyl)-2-(2-thienyl)-4h-1-benzopyran-4-one
Structural Information
- Molecular Formula
- C20H12O3S2
- SMILES
- C1=CSC(=C1)/C=C/C(=O)C2=CC3=C(C=C2)OC(=CC3=O)C4=CC=CS4
- InChI
- InChI=1S/C20H12O3S2/c21-16(7-6-14-3-1-9-24-14)13-5-8-18-15(11-13)17(22)12-19(23-18)20-4-2-10-25-20/h1-12H/b7-6+
- InChIKey
- SDEOGJDJVXOFES-VOTSOKGWSA-N
- Compound name
- 2-thiophen-2-yl-6-[(E)-3-thiophen-2-ylprop-2-enoyl]chromen-4-one
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 365.03008 | 186.0 |
[M+Na]+ | 387.01202 | 198.5 |
[M-H]- | 363.01552 | 199.2 |
[M+NH4]+ | 382.05662 | 203.3 |
[M+K]+ | 402.98596 | 192.8 |
[M+H-H2O]+ | 347.02006 | 181.5 |
[M+HCOO]- | 409.02100 | 202.4 |
[M+CH3COO]- | 423.03665 | 198.9 |
[M+Na-2H]- | 384.99747 | 185.2 |
[M]+ | 364.02225 | 193.8 |
[M]- | 364.02335 | 193.8 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.