CID 52141999

4-[2-(3,5-dimethyl-1h-pyrazol-1-yl)ethyl]morpholine

Structural Information

Molecular Formula
C11H19N3O
SMILES
CC1=CC(=NN1CCN2CCOCC2)C
InChI
InChI=1S/C11H19N3O/c1-10-9-11(2)14(12-10)4-3-13-5-7-15-8-6-13/h9H,3-8H2,1-2H3
InChIKey
AZPGZGOYOJVLIO-UHFFFAOYSA-N
Compound name
4-[2-(3,5-dimethylpyrazol-1-yl)ethyl]morpholine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

209.15282 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 210.16010 149.6
[M+Na]+ 232.14204 156.3
[M-H]- 208.14554 152.2
[M+NH4]+ 227.18664 164.8
[M+K]+ 248.11598 155.0
[M+H-H2O]+ 192.15008 140.6
[M+HCOO]- 254.15102 166.7
[M+CH3COO]- 268.16667 186.4
[M+Na-2H]- 230.12749 152.5
[M]+ 209.15227 148.4
[M]- 209.15337 148.4
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