CID 58334498

4-methyl-4-(propan-2-yl)piperidine hydrochloride

Structural Information

Molecular Formula
C9H19N
SMILES
CC(C)C1(CCNCC1)C
InChI
InChI=1S/C9H19N/c1-8(2)9(3)4-6-10-7-5-9/h8,10H,4-7H2,1-3H3
InChIKey
VWQXZMNSXCIKCM-UHFFFAOYSA-N
Compound name
4-methyl-4-propan-2-ylpiperidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

137
Patents

141.15175 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 142.159026 134.8
[M+Na]+ 164.140968 139.3
[M-H]- 140.144474 134.8
[M+NH4]+ 159.185573 156.2
[M+K]+ 180.114908 138.0
[M+H-H2O]+ 124.149010 129.5
[M+HCOO]- 186.149951 151.2
[M+CH3COO]- 200.165601 172.9
[M+Na-2H]- 162.126416 139.3
[M]+ 141.15120142 128.6
[M]- 141.15229858 128.6
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