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

39
Patents

169.1215 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 170.128776 136.9
[M+Na]+ 192.110718 146.6
[M-H]- 168.114224 138.2
[M+NH4]+ 187.155323 156.9
[M+K]+ 208.084658 145.0
[M+H-H2O]+ 152.118760 130.1
[M+HCOO]- 214.119701 160.5
[M+CH3COO]- 228.135351 183.4
[M+Na-2H]- 190.096166 140.4
[M]+ 169.12095142 139.0
[M]- 169.12204858 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