CID 155973710
1-[3-methyl-5-(trifluoromethyl)thiophen-2-yl]methanamine hydrochloride
Structural Information
- Molecular Formula
- C7H8F3NS
- SMILES
- CC1=C(SC(=C1)C(F)(F)F)CN
- InChI
- InChI=1S/C7H8F3NS/c1-4-2-6(7(8,9)10)12-5(4)3-11/h2H,3,11H2,1H3
- InChIKey
- XMBBCLVSKVIZQH-UHFFFAOYSA-N
- Compound name
- [3-methyl-5-(trifluoromethyl)thiophen-2-yl]methanamine
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 196.04024 | 134.4 |
[M+Na]+ | 218.02218 | 144.4 |
[M-H]- | 194.02568 | 134.5 |
[M+NH4]+ | 213.06678 | 156.2 |
[M+K]+ | 233.99612 | 141.0 |
[M+H-H2O]+ | 178.03022 | 127.1 |
[M+HCOO]- | 240.03116 | 150.6 |
[M+CH3COO]- | 254.04681 | 183.6 |
[M+Na-2H]- | 216.00763 | 135.0 |
[M]+ | 195.03241 | 131.5 |
[M]- | 195.03351 | 131.5 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.