CID 3995430

4-(1h-pyrrol-2-yl)-1,3-thiazol-2-amine

Structural Information

Molecular Formula
C7H7N3S
SMILES
C1=CNC(=C1)C2=CSC(=N2)N
InChI
InChI=1S/C7H7N3S/c8-7-10-6(4-11-7)5-2-1-3-9-5/h1-4,9H,(H2,8,10)
InChIKey
YGOKCJXCDGJCTN-UHFFFAOYSA-N
Compound name
4-(1H-pyrrol-2-yl)-1,3-thiazol-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

165.03607 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 166.04335 130.9
[M+Na]+ 188.02529 142.4
[M+NH4]+ 183.06989 139.8
[M+K]+ 203.99923 138.4
[M-H]- 164.02879 133.7
[M+Na-2H]- 186.01074 138.1
[M]+ 165.03552 133.6
[M]- 165.03662 133.6
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

patents stripe