CID 54592635

2-[(3,5-dimethyl-1h-pyrazol-1-yl)methyl]morpholine

Structural Information

Molecular Formula
C10H17N3O
SMILES
CC1=CC(=NN1CC2CNCCO2)C
InChI
InChI=1S/C10H17N3O/c1-8-5-9(2)13(12-8)7-10-6-11-3-4-14-10/h5,10-11H,3-4,6-7H2,1-2H3
InChIKey
OGQYGLMJTYQJDL-UHFFFAOYSA-N
Compound name
2-[(3,5-dimethylpyrazol-1-yl)methyl]morpholine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

195.13716 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 196.14444 145.9
[M+Na]+ 218.12638 152.6
[M-H]- 194.12988 147.3
[M+NH4]+ 213.17098 161.0
[M+K]+ 234.10032 150.6
[M+H-H2O]+ 178.13442 137.3
[M+HCOO]- 240.13536 161.8
[M+CH3COO]- 254.15101 180.8
[M+Na-2H]- 216.11183 148.8
[M]+ 195.13661 142.5
[M]- 195.13771 142.5
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

No patent data available for this compound.