CID 4961683

(2,2-dichlorocyclopropyl)methanamine

Structural Information

Molecular Formula
C4H7Cl2N
SMILES
C1C(C1(Cl)Cl)CN
InChI
InChI=1S/C4H7Cl2N/c5-4(6)1-3(4)2-7/h3H,1-2,7H2
InChIKey
AZJBFYHLWRPAIH-UHFFFAOYSA-N
Compound name
(2,2-dichlorocyclopropyl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

58
Patents

138.99556 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 140.002836 119.5
[M+Na]+ 161.984778 130.5
[M-H]- 137.988284 123.2
[M+NH4]+ 157.029383 138.9
[M+K]+ 177.958718 126.5
[M+H-H2O]+ 121.992820 117.1
[M+HCOO]- 183.993761 134.8
[M+CH3COO]- 198.009411 176.8
[M+Na-2H]- 159.970226 126.6
[M]+ 138.99501142 122.3
[M]- 138.99610858 122.3
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

patents stripe