CID 138100

4,4-dimethylpiperidine

Structural Information

Molecular Formula
C7H15N
SMILES
CC1(CCNCC1)C
InChI
InChI=1S/C7H15N/c1-7(2)3-5-8-6-4-7/h8H,3-6H2,1-2H3
InChIKey
IECMOFZIMWVOAS-UHFFFAOYSA-N
Compound name
4,4-dimethylpiperidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3186
Patents

113.12045 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 114.12773 125.6
[M+Na]+ 136.10967 131.2
[M-H]- 112.11317 125.9
[M+NH4]+ 131.15427 148.2
[M+K]+ 152.08361 130.0
[M+H-H2O]+ 96.117710 120.6
[M+HCOO]- 158.11865 143.7
[M+CH3COO]- 172.13430 165.9
[M+Na-2H]- 134.09512 132.5
[M]+ 113.11990 119.4
[M]- 113.12100 119.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe