CID 16653076

3-ethyl-4-(thiophen-2-yl)-1h-pyrazol-5-amine

Structural Information

Molecular Formula
C9H11N3S
SMILES
CCC1=C(C(=NN1)N)C2=CC=CS2
InChI
InChI=1S/C9H11N3S/c1-2-6-8(9(10)12-11-6)7-4-3-5-13-7/h3-5H,2H2,1H3,(H3,10,11,12)
InChIKey
RTWOAIQGFKQEFY-UHFFFAOYSA-N
Compound name
5-ethyl-4-thiophen-2-yl-1H-pyrazol-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

193.06737 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 194.07465 140.1
[M+Na]+ 216.05659 151.6
[M+NH4]+ 211.10119 148.6
[M+K]+ 232.03053 147.2
[M-H]- 192.06009 142.9
[M+Na-2H]- 214.04204 146.5
[M]+ 193.06682 142.8
[M]- 193.06792 142.8
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.