CID 11073495

N,n-dimethyl-1h-pyrrole-2-carboxamide

Structural Information

Molecular Formula
C7H10N2O
SMILES
CN(C)C(=O)C1=CC=CN1
InChI
InChI=1S/C7H10N2O/c1-9(2)7(10)6-4-3-5-8-6/h3-5,8H,1-2H3
InChIKey
VZRWJMZZHDOBIO-UHFFFAOYSA-N
Compound name
N,N-dimethyl-1H-pyrrole-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

108
Patents

138.07932 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 139.08660 128.6
[M+Na]+ 161.06854 135.7
[M-H]- 137.07204 131.2
[M+NH4]+ 156.11314 150.3
[M+K]+ 177.04248 135.3
[M+H-H2O]+ 121.07658 122.3
[M+HCOO]- 183.07752 152.8
[M+CH3COO]- 197.09317 174.9
[M+Na-2H]- 159.05399 133.4
[M]+ 138.07877 127.6
[M]- 138.07987 127.6
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

patents stripe