CID 19070661

2,6-dimethylpiperidine-1-carbonyl chloride

Structural Information

Molecular Formula
C8H14ClNO
SMILES
CC1CCCC(N1C(=O)Cl)C
InChI
InChI=1S/C8H14ClNO/c1-6-4-3-5-7(2)10(6)8(9)11/h6-7H,3-5H2,1-2H3
InChIKey
JOPVMXGJULJMLT-UHFFFAOYSA-N
Compound name
2,6-dimethylpiperidine-1-carbonyl chloride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

78
Patents

175.07639 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 176.083666 136.4
[M+Na]+ 198.065608 143.9
[M-H]- 174.069114 138.2
[M+NH4]+ 193.110213 156.5
[M+K]+ 214.039548 141.3
[M+H-H2O]+ 158.073650 131.4
[M+HCOO]- 220.074591 150.5
[M+CH3COO]- 234.090241 179.5
[M+Na-2H]- 196.051056 139.1
[M]+ 175.07584142 134.8
[M]- 175.07693858 134.8
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