CID 12698241

5-chloropentan-1-amine hydrochloride

Structural Information

Molecular Formula
C5H12ClN
SMILES
C(CCN)CCCl
InChI
InChI=1S/C5H12ClN/c6-4-2-1-3-5-7/h1-5,7H2
InChIKey
ZKSVFILTLOPGJC-UHFFFAOYSA-N
Compound name
5-chloropentan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

255
Patents

121.06583 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 122.073106 124.9
[M+Na]+ 144.055048 132.4
[M-H]- 120.058554 124.5
[M+NH4]+ 139.099653 147.7
[M+K]+ 160.028988 129.8
[M+H-H2O]+ 104.063090 121.3
[M+HCOO]- 166.064031 144.8
[M+CH3COO]- 180.079681 172.2
[M+Na-2H]- 142.040496 131.1
[M]+ 121.06528142 125.6
[M]- 121.06637858 125.6
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