CID 4988991

2-(morpholin-4-yl)-2-(pyrid-3-yl)ethylamine

Structural Information

Molecular Formula
C11H17N3O
SMILES
C1COCCN1C(CN)C2=CN=CC=C2
InChI
InChI=1S/C11H17N3O/c12-8-11(10-2-1-3-13-9-10)14-4-6-15-7-5-14/h1-3,9,11H,4-8,12H2
InChIKey
QSKWIAMIMXGSJN-UHFFFAOYSA-N
Compound name
2-morpholin-4-yl-2-pyridin-3-ylethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

111
Patents

207.13716 Da
Monoisotopic Mass

-0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 208.144436 148.0
[M+Na]+ 230.126378 151.7
[M-H]- 206.129884 150.8
[M+NH4]+ 225.170983 161.5
[M+K]+ 246.100318 150.3
[M+H-H2O]+ 190.134420 138.7
[M+HCOO]- 252.135361 165.1
[M+CH3COO]- 266.151011 186.5
[M+Na-2H]- 228.111826 153.6
[M]+ 207.13661142 142.4
[M]- 207.13770858 142.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe