CID 2825283

13219-74-4

Structural Information

Molecular Formula
C11H18N2O
SMILES
CCC1=C(NC(=C1C)C(=O)N(C)C)C
InChI
InChI=1S/C11H18N2O/c1-6-9-7(2)10(12-8(9)3)11(14)13(4)5/h12H,6H2,1-5H3
InChIKey
MCNDHWWSFSXHMJ-UHFFFAOYSA-N
Compound name
4-ethyl-N,N,3,5-tetramethyl-1H-pyrrole-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

194.1419 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 195.14918 145.3
[M+Na]+ 217.13112 153.5
[M-H]- 193.13462 148.3
[M+NH4]+ 212.17572 165.7
[M+K]+ 233.10506 152.1
[M+H-H2O]+ 177.13916 139.2
[M+HCOO]- 239.14010 168.1
[M+CH3COO]- 253.15575 190.6
[M+Na-2H]- 215.11657 145.9
[M]+ 194.14135 146.9
[M]- 194.14245 146.9
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.