CID 21183363

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

Structural Information

Molecular Formula
C3H5N3S
SMILES
CC1=C(SN=N1)N
InChI
InChI=1S/C3H5N3S/c1-2-3(4)7-6-5-2/h4H2,1H3
InChIKey
SFSIEYMUSZBOJK-UHFFFAOYSA-N
Compound name
4-methylthiadiazol-5-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

21
Patents

115.02042 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 116.02770 119.3
[M+Na]+ 138.00964 130.1
[M+NH4]+ 133.05424 128.1
[M+K]+ 153.98358 125.0
[M-H]- 114.01314 120.5
[M+Na-2H]- 135.99509 124.6
[M]+ 115.01987 121.4
[M]- 115.02097 121.4
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