CID 19047178

5-chloropentanamide

Structural Information

Molecular Formula
C5H10ClNO
SMILES
C(CCCl)CC(=O)N
InChI
InChI=1S/C5H10ClNO/c6-4-2-1-3-5(7)8/h1-4H2,(H2,7,8)
InChIKey
DCPLYSRLHGHNMY-UHFFFAOYSA-N
Compound name
5-chloropentanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

115
Patents

135.04509 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 136.05237 126.8
[M+Na]+ 158.03431 134.4
[M-H]- 134.03781 126.6
[M+NH4]+ 153.07891 148.9
[M+K]+ 174.00825 132.1
[M+H-H2O]+ 118.04235 123.2
[M+HCOO]- 180.04329 146.2
[M+CH3COO]- 194.05894 174.0
[M+Na-2H]- 156.01976 131.8
[M]+ 135.04454 127.7
[M]- 135.04564 127.7
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