CID 213769

Brn 1540700

Structural Information

Molecular Formula
C14H18Cl2N2
SMILES
CC(C)CN1CCCC1=NC2=C(C=C(C=C2)Cl)Cl
InChI
InChI=1S/C14H18Cl2N2/c1-10(2)9-18-7-3-4-14(18)17-13-6-5-11(15)8-12(13)16/h5-6,8,10H,3-4,7,9H2,1-2H3
InChIKey
CAUXVZKQNYZICW-UHFFFAOYSA-N
Compound name
N-(2,4-dichlorophenyl)-1-(2-methylpropyl)pyrrolidin-2-imine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

284.08472 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 285.091996 167.7
[M+Na]+ 307.073938 175.7
[M-H]- 283.077444 173.2
[M+NH4]+ 302.118543 185.8
[M+K]+ 323.047878 169.6
[M+H-H2O]+ 267.081980 160.7
[M+HCOO]- 329.082921 180.4
[M+CH3COO]- 343.098571 203.5
[M+Na-2H]- 305.059386 167.1
[M]+ 284.08417142 169.1
[M]- 284.08526858 169.1
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.