CID 92135146

2413869-21-1

Structural Information

Molecular Formula
C5H9N3S
SMILES
C1=NN=C(S1)CCCN
InChI
InChI=1S/C5H9N3S/c6-3-1-2-5-8-7-4-9-5/h4H,1-3,6H2
InChIKey
SHJZOCMQNQHQGZ-UHFFFAOYSA-N
Compound name
3-(1,3,4-thiadiazol-2-yl)propan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

143.05171 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 144.05899 127.6
[M+Na]+ 166.04093 137.7
[M+NH4]+ 161.08553 136.1
[M+K]+ 182.01487 131.9
[M-H]- 142.04443 128.7
[M+Na-2H]- 164.02638 132.7
[M]+ 143.05116 129.6
[M]- 143.05226 129.6
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.