CID 104578

53725-39-6

Structural Information

Molecular Formula
C14H26N2O
SMILES
CCN(CC)C(=O)CN1C(C=CC1(C)C)(C)C
InChI
InChI=1S/C14H26N2O/c1-7-15(8-2)12(17)11-16-13(3,4)9-10-14(16,5)6/h9-10H,7-8,11H2,1-6H3
InChIKey
JWQGDHYHIWAQGT-UHFFFAOYSA-N
Compound name
N,N-diethyl-2-(2,2,5,5-tetramethylpyrrol-1-yl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

238.20451 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 239.21179 154.4
[M+Na]+ 261.19373 161.7
[M-H]- 237.19723 158.3
[M+NH4]+ 256.23833 177.6
[M+K]+ 277.16767 161.2
[M+H-H2O]+ 221.20177 149.6
[M+HCOO]- 283.20271 176.4
[M+CH3COO]- 297.21836 200.7
[M+Na-2H]- 259.17918 156.7
[M]+ 238.20396 158.0
[M]- 238.20506 158.0
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.