CID 86650820

4-(morpholinomethyl)-1h-pyrrole-2-carbaldehyde

Structural Information

Molecular Formula
C10H14N2O2
SMILES
C1COCCN1CC2=CNC(=C2)C=O
InChI
InChI=1S/C10H14N2O2/c13-8-10-5-9(6-11-10)7-12-1-3-14-4-2-12/h5-6,8,11H,1-4,7H2
InChIKey
PHQUVWAXOLMNRU-UHFFFAOYSA-N
Compound name
4-(morpholin-4-ylmethyl)-1H-pyrrole-2-carbaldehyde
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

19
Patents

194.10553 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 195.11281 143.8
[M+Na]+ 217.09475 154.6
[M+NH4]+ 212.13935 151.1
[M+K]+ 233.06869 151.0
[M-H]- 193.09825 146.4
[M+Na-2H]- 215.08020 148.6
[M]+ 194.10498 145.8
[M]- 194.10608 145.8
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