CID 103079197

1-methyl-3-[(3-methylbutan-2-yl)oxy]-1h-pyrazol-4-amine hydrochloride

Structural Information

Molecular Formula
C9H17N3O
SMILES
CC(C)C(C)OC1=NN(C=C1N)C
InChI
InChI=1S/C9H17N3O/c1-6(2)7(3)13-9-8(10)5-12(4)11-9/h5-7H,10H2,1-4H3
InChIKey
GPNOGAGORCXLRT-UHFFFAOYSA-N
Compound name
1-methyl-3-(3-methylbutan-2-yloxy)pyrazol-4-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

183.13716 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 184.144436 142.5
[M+Na]+ 206.126378 150.3
[M-H]- 182.129884 143.5
[M+NH4]+ 201.170983 161.5
[M+K]+ 222.100318 149.5
[M+H-H2O]+ 166.134420 135.4
[M+HCOO]- 228.135361 163.9
[M+CH3COO]- 242.151011 187.0
[M+Na-2H]- 204.111826 143.8
[M]+ 183.13661142 143.4
[M]- 183.13770858 143.4
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.