CID 3033763

Brn 5511163

Structural Information

Molecular Formula
C8H12N4
SMILES
CN(C)/C=C\1/CCN=C1NC#N
InChI
InChI=1S/C8H12N4/c1-12(2)5-7-3-4-10-8(7)11-6-9/h5H,3-4H2,1-2H3,(H,10,11)/b7-5-
InChIKey
MUSFFBRTUORQMT-ALCCZGGFSA-N
Compound name
[(4Z)-4-(dimethylaminomethylidene)-2,3-dihydropyrrol-5-yl]cyanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

164.1062 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 165.11348 140.4
[M+Na]+ 187.09542 148.9
[M+NH4]+ 182.14002 144.5
[M+K]+ 203.06936 142.0
[M-H]- 163.09892 134.7
[M+Na-2H]- 185.08087 142.5
[M]+ 164.10565 138.8
[M]- 164.10675 138.8
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.