CID 4100429

4-methyl-1-propylpiperidine

Structural Information

Molecular Formula
C9H19N
SMILES
CCCN1CCC(CC1)C
InChI
InChI=1S/C9H19N/c1-3-6-10-7-4-9(2)5-8-10/h9H,3-8H2,1-2H3
InChIKey
FOAQPTXFAULJNM-UHFFFAOYSA-N
Compound name
4-methyl-1-propylpiperidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

225
Patents

141.15175 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 142.15903 133.7
[M+Na]+ 164.14097 145.1
[M+NH4]+ 159.18557 143.0
[M+K]+ 180.11491 138.0
[M-H]- 140.14447 135.9
[M+Na-2H]- 162.12642 139.1
[M]+ 141.15120 135.8
[M]- 141.15230 135.8
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