CID 11686921

3-(1,3-thiazol-2-yl)propan-1-amine

Structural Information

Molecular Formula
C6H10N2S
SMILES
C1=CSC(=N1)CCCN
InChI
InChI=1S/C6H10N2S/c7-3-1-2-6-8-4-5-9-6/h4-5H,1-3,7H2
InChIKey
FPKQNDZQVDBFLK-UHFFFAOYSA-N
Compound name
3-(1,3-thiazol-2-yl)propan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

89
Patents

142.05647 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 143.06375 127.2
[M+Na]+ 165.04569 135.5
[M-H]- 141.04919 129.3
[M+NH4]+ 160.09029 149.4
[M+K]+ 181.01963 133.3
[M+H-H2O]+ 125.05373 121.0
[M+HCOO]- 187.05467 147.3
[M+CH3COO]- 201.07032 173.0
[M+Na-2H]- 163.03114 130.4
[M]+ 142.05592 127.7
[M]- 142.05702 127.7
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

patents stripe