CID 351685

4-[(dimethylamino)methyl]-1,3-thiazol-2-amine

Structural Information

Molecular Formula
C6H11N3S
SMILES
CN(C)CC1=CSC(=N1)N
InChI
InChI=1S/C6H11N3S/c1-9(2)3-5-4-10-6(7)8-5/h4H,3H2,1-2H3,(H2,7,8)
InChIKey
HYQAPLLDHDEUSD-UHFFFAOYSA-N
Compound name
4-[(dimethylamino)methyl]-1,3-thiazol-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

30
Patents

157.06737 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 158.07465 131.2
[M+Na]+ 180.05659 139.6
[M-H]- 156.06009 135.1
[M+NH4]+ 175.10119 153.3
[M+K]+ 196.03053 138.5
[M+H-H2O]+ 140.06463 124.5
[M+HCOO]- 202.06557 152.6
[M+CH3COO]- 216.08122 182.4
[M+Na-2H]- 178.04204 133.5
[M]+ 157.06682 132.6
[M]- 157.06792 132.6
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