CID 12218437

3-(methoxymethyl)-5-methyl-1h-pyrazole

Structural Information

Molecular Formula
C6H10N2O
SMILES
CC1=CC(=NN1)COC
InChI
InChI=1S/C6H10N2O/c1-5-3-6(4-9-2)8-7-5/h3H,4H2,1-2H3,(H,7,8)
InChIKey
ZPUMXRHDEOSKCH-UHFFFAOYSA-N
Compound name
3-(methoxymethyl)-5-methyl-1H-pyrazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

6
Patents

126.079315 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 127.08659 125.1
[M+Na]+ 149.06853 136.5
[M+NH4]+ 144.11314 132.8
[M+K]+ 165.04247 132.9
[M-H]- 125.07204 124.9
[M+Na-2H]- 147.05398 130.4
[M]+ 126.07877 126.4
[M]- 126.07986 126.4
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