CID 50988248
1308910-95-3
Structural Information
- Molecular Formula
- C10H11NO2S2
- SMILES
- CCOC(=O)C1=C(C2=C(S1)C=CS2)CN
- InChI
- InChI=1S/C10H11NO2S2/c1-2-13-10(12)9-6(5-11)8-7(15-9)3-4-14-8/h3-4H,2,5,11H2,1H3
- InChIKey
- VVJSRWIIPYTVHH-UHFFFAOYSA-N
- Compound name
- ethyl 6-(aminomethyl)thieno[3,2-b]thiophene-5-carboxylate
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 242.03040 | 151.9 |
[M+Na]+ | 264.01234 | 162.8 |
[M-H]- | 240.01584 | 157.1 |
[M+NH4]+ | 259.05694 | 175.0 |
[M+K]+ | 279.98628 | 158.9 |
[M+H-H2O]+ | 224.02038 | 147.7 |
[M+HCOO]- | 286.02132 | 168.0 |
[M+CH3COO]- | 300.03697 | 190.1 |
[M+Na-2H]- | 261.99779 | 151.2 |
[M]+ | 241.02257 | 158.3 |
[M]- | 241.02367 | 158.3 |
Literature stripe
Patent stripe
No patent data available for this compound.