CID 28412447

1-(2-methoxyethyl)-3,5-dimethyl-1h-pyrazol-4-amine

Structural Information

Molecular Formula
C8H15N3O
SMILES
CC1=C(C(=NN1CCOC)C)N
InChI
InChI=1S/C8H15N3O/c1-6-8(9)7(2)11(10-6)4-5-12-3/h4-5,9H2,1-3H3
InChIKey
OJFKWBPHMXLALP-UHFFFAOYSA-N
Compound name
1-(2-methoxyethyl)-3,5-dimethylpyrazol-4-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

42
Patents

169.1215 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 170.12878 136.9
[M+Na]+ 192.11072 146.6
[M-H]- 168.11422 138.2
[M+NH4]+ 187.15532 156.9
[M+K]+ 208.08466 145.0
[M+H-H2O]+ 152.11876 130.1
[M+HCOO]- 214.11970 160.5
[M+CH3COO]- 228.13535 183.4
[M+Na-2H]- 190.09617 140.4
[M]+ 169.12095 139.0
[M]- 169.12205 139.0
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

patents stripe