CID 61263872
1247635-33-1
Structural Information
- Molecular Formula
- C12H15N3S
- SMILES
- CC(C1=CC(=CC=C1)N)SC2=NC=CN2C
- InChI
- InChI=1S/C12H15N3S/c1-9(10-4-3-5-11(13)8-10)16-12-14-6-7-15(12)2/h3-9H,13H2,1-2H3
- InChIKey
- WAGIIXPVQHVZRC-UHFFFAOYSA-N
- Compound name
- 3-[1-(1-methylimidazol-2-yl)sulfanylethyl]aniline
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 234.10594 | 151.9 |
[M+Na]+ | 256.08788 | 164.1 |
[M+NH4]+ | 251.13248 | 160.5 |
[M+K]+ | 272.06182 | 157.4 |
[M-H]- | 232.09138 | 155.6 |
[M+Na-2H]- | 254.07333 | 158.9 |
[M]+ | 233.09811 | 155.1 |
[M]- | 233.09921 | 155.1 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.