CID 260021

Pyrrole, 1-(2-(2-(diethylamino)ethoxy)ethyl)-2,5-dimethyl-

Structural Information

Molecular Formula
C14H26N2O
SMILES
CCN(CC)CCOCCN1C(=CC=C1C)C
InChI
InChI=1S/C14H26N2O/c1-5-15(6-2)9-11-17-12-10-16-13(3)7-8-14(16)4/h7-8H,5-6,9-12H2,1-4H3
InChIKey
NBEJIEWYTIJTGQ-UHFFFAOYSA-N
Compound name
2-[2-(2,5-dimethylpyrrol-1-yl)ethoxy]-N,N-diethylethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

5
References

0
Patents

238.20451 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 239.21179 160.1
[M+Na]+ 261.19373 166.4
[M-H]- 237.19723 163.3
[M+NH4]+ 256.23833 179.2
[M+K]+ 277.16767 165.2
[M+H-H2O]+ 221.20177 152.5
[M+HCOO]- 283.20271 184.1
[M+CH3COO]- 297.21836 201.7
[M+Na-2H]- 259.17918 161.5
[M]+ 238.20396 165.8
[M]- 238.20506 165.8
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.