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]+ 140.00284 119.5
[M+Na]+ 161.98478 130.5
[M-H]- 137.98828 123.2
[M+NH4]+ 157.02938 138.9
[M+K]+ 177.95872 126.5
[M+H-H2O]+ 121.99282 117.1
[M+HCOO]- 183.99376 134.8
[M+CH3COO]- 198.00941 176.8
[M+Na-2H]- 159.97023 126.6
[M]+ 138.99501 122.3
[M]- 138.99611 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