CID 3040676

Perimidine, 1-(2-morpholinoethyl)-

Structural Information

Molecular Formula
C17H19N3O
SMILES
C1COCCN1CCN2C=NC3=CC=CC4=C3C2=CC=C4
InChI
InChI=1S/C17H19N3O/c1-3-14-4-2-6-16-17(14)15(5-1)18-13-20(16)8-7-19-9-11-21-12-10-19/h1-6,13H,7-12H2
InChIKey
JPZVVTJVMJQFLP-UHFFFAOYSA-N
Compound name
4-(2-perimidin-1-ylethyl)morpholine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

281.1528 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 282.16008 166.7
[M+Na]+ 304.14202 172.4
[M-H]- 280.14552 169.3
[M+NH4]+ 299.18662 178.5
[M+K]+ 320.11596 168.0
[M+H-H2O]+ 264.15006 155.0
[M+HCOO]- 326.15100 178.8
[M+CH3COO]- 340.16665 175.7
[M+Na-2H]- 302.12747 174.2
[M]+ 281.15225 164.2
[M]- 281.15335 164.2
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

No patent data available for this compound.