CID 7175814

[(1-ethyl-5-methyl-1h-pyrazol-4-yl)methyl](methyl)amine

Structural Information

Molecular Formula
C8H15N3
SMILES
CCN1C(=C(C=N1)CNC)C
InChI
InChI=1S/C8H15N3/c1-4-11-7(2)8(5-9-3)6-10-11/h6,9H,4-5H2,1-3H3
InChIKey
PGEMPURRTUBTRN-UHFFFAOYSA-N
Compound name
1-(1-ethyl-5-methylpyrazol-4-yl)-N-methylmethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

21
Patents

153.1266 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 154.133876 133.7
[M+Na]+ 176.115818 142.5
[M-H]- 152.119324 135.0
[M+NH4]+ 171.160423 154.3
[M+K]+ 192.089758 140.9
[M+H-H2O]+ 136.123860 126.6
[M+HCOO]- 198.124801 157.7
[M+CH3COO]- 212.140451 180.9
[M+Na-2H]- 174.101266 139.0
[M]+ 153.12605142 135.0
[M]- 153.12714858 135.0
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