CID 64975557

2-cyclopropyl-4,5,6,7-tetrahydro-1,3-benzothiazol-4-amine

Structural Information

Molecular Formula
C10H14N2S
SMILES
C1CC(C2=C(C1)SC(=N2)C3CC3)N
InChI
InChI=1S/C10H14N2S/c11-7-2-1-3-8-9(7)12-10(13-8)6-4-5-6/h6-7H,1-5,11H2
InChIKey
PHWIKBJCFXYTFL-UHFFFAOYSA-N
Compound name
2-cyclopropyl-4,5,6,7-tetrahydro-1,3-benzothiazol-4-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

194.08777 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 195.09505 136.6
[M+Na]+ 217.07699 146.3
[M-H]- 193.08049 143.0
[M+NH4]+ 212.12159 153.1
[M+K]+ 233.05093 141.8
[M+H-H2O]+ 177.08503 130.4
[M+HCOO]- 239.08597 153.2
[M+CH3COO]- 253.10162 149.3
[M+Na-2H]- 215.06244 138.8
[M]+ 194.08722 136.9
[M]- 194.08832 136.9
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.