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]+ 184.14444 142.5
[M+Na]+ 206.12638 150.3
[M-H]- 182.12988 143.5
[M+NH4]+ 201.17098 161.5
[M+K]+ 222.10032 149.5
[M+H-H2O]+ 166.13442 135.4
[M+HCOO]- 228.13536 163.9
[M+CH3COO]- 242.15101 187.0
[M+Na-2H]- 204.11183 143.8
[M]+ 183.13661 143.4
[M]- 183.13771 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.