CID 579620

2094301-50-3

Structural Information

Molecular Formula
C8H15N3
SMILES
CC1=C(C(=NN1C)C)CNC
InChI
InChI=1S/C8H15N3/c1-6-8(5-9-3)7(2)11(4)10-6/h9H,5H2,1-4H3
InChIKey
DBORGGVCQYVMEP-UHFFFAOYSA-N
Compound name
N-methyl-1-(1,3,5-trimethylpyrazol-4-yl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

18
Patents

153.1266 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 154.13388 133.5
[M+Na]+ 176.11582 143.3
[M-H]- 152.11932 135.3
[M+NH4]+ 171.16042 154.5
[M+K]+ 192.08976 141.6
[M+H-H2O]+ 136.12386 126.9
[M+HCOO]- 198.12480 157.5
[M+CH3COO]- 212.14045 182.0
[M+Na-2H]- 174.10127 138.1
[M]+ 153.12605 135.2
[M]- 153.12715 135.2
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