CID 80321602

1-[(4-methyl-1,3-thiazol-2-yl)methyl]cyclobutan-1-amine hydrochloride

Structural Information

Molecular Formula
C9H14N2S
SMILES
CC1=CSC(=N1)CC2(CCC2)N
InChI
InChI=1S/C9H14N2S/c1-7-6-12-8(11-7)5-9(10)3-2-4-9/h6H,2-5,10H2,1H3
InChIKey
GFJREXZBPURNGY-UHFFFAOYSA-N
Compound name
1-[(4-methyl-1,3-thiazol-2-yl)methyl]cyclobutan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

182.08777 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 183.09505 135.2
[M+Na]+ 205.07699 141.4
[M-H]- 181.08049 140.2
[M+NH4]+ 200.12159 151.0
[M+K]+ 221.05093 141.6
[M+H-H2O]+ 165.08503 124.0
[M+HCOO]- 227.08597 152.5
[M+CH3COO]- 241.10162 184.1
[M+Na-2H]- 203.06244 137.2
[M]+ 182.08722 143.3
[M]- 182.08832 143.3
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

No patent data available for this compound.