CID 47019

Ar-35

Structural Information

Molecular Formula
C15H23N2O2
SMILES
C[N+](C)(C)C1=CC(=CC=C1)OC(=O)N2CCCCC2
InChI
InChI=1S/C15H23N2O2/c1-17(2,3)13-8-7-9-14(12-13)19-15(18)16-10-5-4-6-11-16/h7-9,12H,4-6,10-11H2,1-3H3/q+1
InChIKey
SFCKTALGSAMTBK-UHFFFAOYSA-N
Compound name
trimethyl-[3-(piperidine-1-carbonyloxy)phenyl]azanium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

263.17596 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 264.18324 161.2
[M+Na]+ 286.16518 165.0
[M-H]- 262.16868 167.2
[M+NH4]+ 281.20978 176.5
[M+K]+ 302.13912 157.9
[M+H-H2O]+ 246.17322 155.7
[M+HCOO]- 308.17416 179.8
[M+CH3COO]- 322.18981 193.4
[M+Na-2H]- 284.15063 168.1
[M]+ 263.17541 157.5
[M]- 263.17651 157.5
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

No patent data available for this compound.