CID 3040674

Perimidine, 1-(2-(diethylamino)ethyl)-

Structural Information

Molecular Formula
C17H21N3
SMILES
CCN(CC)CCN1C=NC2=CC=CC3=C2C1=CC=C3
InChI
InChI=1S/C17H21N3/c1-3-19(4-2)11-12-20-13-18-15-9-5-7-14-8-6-10-16(20)17(14)15/h5-10,13H,3-4,11-12H2,1-2H3
InChIKey
UEGYULBVVVGGBO-UHFFFAOYSA-N
Compound name
N,N-diethyl-2-perimidin-1-ylethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

267.17355 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 268.180826 165.1
[M+Na]+ 290.162768 171.8
[M-H]- 266.166274 167.5
[M+NH4]+ 285.207373 181.5
[M+K]+ 306.136708 167.5
[M+H-H2O]+ 250.170810 155.4
[M+HCOO]- 312.171751 183.9
[M+CH3COO]- 326.187401 175.8
[M+Na-2H]- 288.148216 173.0
[M]+ 267.17300142 167.8
[M]- 267.17409858 167.8
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

No patent data available for this compound.