CID 9591311
2-thienyl-n,n-bis(2-thienylmethylene)methanediamine
Structural Information
- Molecular Formula
- C15H12N2S3
- SMILES
- C1=CSC(=C1)/C=N/C(/N=C/C2=CC=CS2)C3=CC=CS3
- InChI
- InChI=1S/C15H12N2S3/c1-4-12(18-7-1)10-16-15(14-6-3-9-20-14)17-11-13-5-2-8-19-13/h1-11,15H/b16-10+,17-11+
- InChIKey
- JFBOACJJWSHXAS-OTYYAQKOSA-N
- Compound name
- (E)-1-thiophen-2-yl-N-[thiophen-2-yl-[(E)-thiophen-2-ylmethylideneamino]methyl]methanimine
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 317.02355 | 176.7 |
[M+Na]+ | 339.00549 | 188.2 |
[M-H]- | 315.00899 | 190.0 |
[M+NH4]+ | 334.05009 | 198.4 |
[M+K]+ | 354.97943 | 182.5 |
[M+H-H2O]+ | 299.01353 | 171.2 |
[M+HCOO]- | 361.01447 | 194.2 |
[M+CH3COO]- | 375.03012 | 189.8 |
[M+Na-2H]- | 336.99094 | 174.9 |
[M]+ | 316.01572 | 182.0 |
[M]- | 316.01682 | 182.0 |
Literature stripe
Patent stripe
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