CID 23092533

3-cyclopropyl-1,2,4-thiadiazol-5-amine

Structural Information

Molecular Formula
C5H7N3S
SMILES
C1CC1C2=NSC(=N2)N
InChI
InChI=1S/C5H7N3S/c6-5-7-4(8-9-5)3-1-2-3/h3H,1-2H2,(H2,6,7,8)
InChIKey
PWMKMGJWPFSQIE-UHFFFAOYSA-N
Compound name
3-cyclopropyl-1,2,4-thiadiazol-5-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

70
Patents

141.03607 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 142.04335 129.1
[M+Na]+ 164.02529 141.2
[M+NH4]+ 159.06989 138.5
[M+K]+ 179.99923 137.0
[M-H]- 140.02879 138.4
[M+Na-2H]- 162.01074 137.5
[M]+ 141.03552 134.8
[M]- 141.03662 134.8
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

patents stripe