CID 16642529
927966-12-9
Structural Information
- Molecular Formula
- C14H14N2OS
- SMILES
- C1CC2=C(C=CC(=C2)N)N(C1)C(=O)C3=CC=CS3
- InChI
- InChI=1S/C14H14N2OS/c15-11-5-6-12-10(9-11)3-1-7-16(12)14(17)13-4-2-8-18-13/h2,4-6,8-9H,1,3,7,15H2
- InChIKey
- XIMYGKBPDPDMOX-UHFFFAOYSA-N
- Compound name
- (6-amino-3,4-dihydro-2H-quinolin-1-yl)-thiophen-2-ylmethanone
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 259.08995 | 156.7 |
[M+Na]+ | 281.07189 | 164.3 |
[M-H]- | 257.07539 | 162.6 |
[M+NH4]+ | 276.11649 | 175.2 |
[M+K]+ | 297.04583 | 159.5 |
[M+H-H2O]+ | 241.07993 | 149.9 |
[M+HCOO]- | 303.08087 | 172.5 |
[M+CH3COO]- | 317.09652 | 168.4 |
[M+Na-2H]- | 279.05734 | 157.7 |
[M]+ | 258.08212 | 155.0 |
[M]- | 258.08322 | 155.0 |
Literature stripe
Patent stripe
No patent data available for this compound.