CID 4737030

2,4,5-trimethyl-2,3-dihydro-1h-pyrazol-3-imine

Structural Information

Molecular Formula
C6H11N3
SMILES
CC1=C(N(N=C1C)C)N
InChI
InChI=1S/C6H11N3/c1-4-5(2)8-9(3)6(4)7/h7H2,1-3H3
InChIKey
RXNRZXTWCRTHPR-UHFFFAOYSA-N
Compound name
2,4,5-trimethylpyrazol-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

25
Patents

125.0953 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 126.10258 124.8
[M+Na]+ 148.08452 135.4
[M-H]- 124.08802 126.4
[M+NH4]+ 143.12912 146.6
[M+K]+ 164.05846 133.9
[M+H-H2O]+ 108.09256 118.5
[M+HCOO]- 170.09350 148.8
[M+CH3COO]- 184.10915 175.3
[M+Na-2H]- 146.06997 129.4
[M]+ 125.09475 124.7
[M]- 125.09585 124.7
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