CID 512360

Imidazo[1,2-a]pyridine, 7-methyl-3-[(propylthio)methyl]-

Structural Information

Molecular Formula
C12H16N2S
SMILES
CCCSCC1=CN=C2N1C=CC(=C2)C
InChI
InChI=1S/C12H16N2S/c1-3-6-15-9-11-8-13-12-7-10(2)4-5-14(11)12/h4-5,7-8H,3,6,9H2,1-2H3
InChIKey
MAENJOMCZJORJD-UHFFFAOYSA-N
Compound name
7-methyl-3-(propylsulfanylmethyl)imidazo[1,2-a]pyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

220.10342 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 221.11070 147.5
[M+Na]+ 243.09264 158.8
[M-H]- 219.09614 150.3
[M+NH4]+ 238.13724 167.8
[M+K]+ 259.06658 154.4
[M+H-H2O]+ 203.10068 140.9
[M+HCOO]- 265.10162 165.7
[M+CH3COO]- 279.11727 161.0
[M+Na-2H]- 241.07809 150.9
[M]+ 220.10287 153.8
[M]- 220.10397 153.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.