CID 86030

2-amino-4-thiazoline

Structural Information

Molecular Formula
C3H6N2S
SMILES
C1=CSC(N1)N
InChI
InChI=1S/C3H6N2S/c4-3-5-1-2-6-3/h1-3,5H,4H2
InChIKey
JHXOAXMCYMGJLQ-UHFFFAOYSA-N
Compound name
2,3-dihydro-1,3-thiazol-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

33
References

334
Patents

102.02517 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 103.032446 116.1
[M+Na]+ 125.014388 124.3
[M-H]- 101.017894 117.0
[M+NH4]+ 120.058993 139.1
[M+K]+ 140.988328 122.1
[M+H-H2O]+ 85.022430 110.7
[M+HCOO]- 147.023371 134.2
[M+CH3COO]- 161.039021 161.7
[M+Na-2H]- 122.999836 119.4
[M]+ 102.02462142 112.3
[M]- 102.02571858 112.3
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe