CID 216550

Brn 1474570

Structural Information

Molecular Formula
C15H18Cl2N2
SMILES
CC1=CC(=C(C=C1N=C2CCCN2C=C(C)C)Cl)Cl
InChI
InChI=1S/C15H18Cl2N2/c1-10(2)9-19-6-4-5-15(19)18-14-8-13(17)12(16)7-11(14)3/h7-9H,4-6H2,1-3H3
InChIKey
PRKTZTZJXWJZGY-UHFFFAOYSA-N
Compound name
N-(4,5-dichloro-2-methylphenyl)-1-(2-methylprop-1-enyl)pyrrolidin-2-imine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

296.08472 Da
Monoisotopic Mass

4.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 297.09200 171.5
[M+Na]+ 319.07394 180.3
[M-H]- 295.07744 177.2
[M+NH4]+ 314.11854 189.4
[M+K]+ 335.04788 173.4
[M+H-H2O]+ 279.08198 164.7
[M+HCOO]- 341.08292 184.0
[M+CH3COO]- 355.09857 206.1
[M+Na-2H]- 317.05939 169.6
[M]+ 296.08417 172.8
[M]- 296.08527 172.8
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.