CID 30206

R 430

Structural Information

Molecular Formula
C14H25N3O
SMILES
CCCN(CCC)CC(=O)NN1C(=CC=C1C)C
InChI
InChI=1S/C14H25N3O/c1-5-9-16(10-6-2)11-14(18)15-17-12(3)7-8-13(17)4/h7-8H,5-6,9-11H2,1-4H3,(H,15,18)
InChIKey
SQYOWGNPSZUREF-UHFFFAOYSA-N
Compound name
N-(2,5-dimethylpyrrol-1-yl)-2-(dipropylamino)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

251.19977 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 252.20705 163.7
[M+Na]+ 274.18899 169.1
[M-H]- 250.19249 167.1
[M+NH4]+ 269.23359 181.8
[M+K]+ 290.16293 167.8
[M+H-H2O]+ 234.19703 155.8
[M+HCOO]- 296.19797 188.0
[M+CH3COO]- 310.21362 206.0
[M+Na-2H]- 272.17444 164.2
[M]+ 251.19922 167.1
[M]- 251.20032 167.1
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.