CID 4682015

Cyclopropyl(2,5-dichlorophenyl)methanamine

Structural Information

Molecular Formula
C10H11Cl2N
SMILES
C1CC1C(C2=C(C=CC(=C2)Cl)Cl)N
InChI
InChI=1S/C10H11Cl2N/c11-7-3-4-9(12)8(5-7)10(13)6-1-2-6/h3-6,10H,1-2,13H2
InChIKey
VRSRQMBHNJEIJF-UHFFFAOYSA-N
Compound name
cyclopropyl-(2,5-dichlorophenyl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

215.02686 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 216.03414 136.5
[M+Na]+ 238.01608 146.6
[M-H]- 214.01958 142.7
[M+NH4]+ 233.06068 151.3
[M+K]+ 253.99002 140.7
[M+H-H2O]+ 198.02412 131.7
[M+HCOO]- 260.02506 151.4
[M+CH3COO]- 274.04071 191.5
[M+Na-2H]- 236.00153 140.6
[M]+ 215.02631 139.3
[M]- 215.02741 139.3
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.