CID 60923099

3-cyclopentyl-1,2,4-thiadiazol-5-amine

Structural Information

Molecular Formula
C7H11N3S
SMILES
C1CCC(C1)C2=NSC(=N2)N
InChI
InChI=1S/C7H11N3S/c8-7-9-6(10-11-7)5-3-1-2-4-5/h5H,1-4H2,(H2,8,9,10)
InChIKey
IKRIQQIAOZBZNZ-UHFFFAOYSA-N
Compound name
3-cyclopentyl-1,2,4-thiadiazol-5-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

169.06737 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 170.07465 134.2
[M+Na]+ 192.05659 142.7
[M-H]- 168.06009 138.5
[M+NH4]+ 187.10119 155.8
[M+K]+ 208.03053 140.5
[M+H-H2O]+ 152.06463 127.3
[M+HCOO]- 214.06557 152.5
[M+CH3COO]- 228.08122 147.6
[M+Na-2H]- 190.04204 134.2
[M]+ 169.06682 132.0
[M]- 169.06792 132.0
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.