CID 5314658

4-methylenepiperidine hydrochloride

Structural Information

Molecular Formula
C6H11N
SMILES
C=C1CCNCC1
InChI
InChI=1S/C6H11N/c1-6-2-4-7-5-3-6/h7H,1-5H2
InChIKey
LPKIGDXRQSIQBA-UHFFFAOYSA-N
Compound name
4-methylidenepiperidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

654
Patents

97.08915 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 98.096426 120.1
[M+Na]+ 120.07837 125.5
[M-H]- 96.081874 120.2
[M+NH4]+ 115.12297 141.1
[M+K]+ 136.05231 123.6
[M+H-H2O]+ 80.086410 114.5
[M+HCOO]- 142.08735 138.7
[M+CH3COO]- 156.10300 162.4
[M+Na-2H]- 118.06382 126.5
[M]+ 97.088601 112.5
[M]- 97.089699 112.5
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