CID 45676

Tl-1889

Structural Information

Molecular Formula
C15H23N2O2
SMILES
CNC(=O)OC1=CC=CC2=C1CCCC2[N+](C)(C)C
InChI
InChI=1S/C15H22N2O2/c1-16-15(18)19-14-10-6-7-11-12(14)8-5-9-13(11)17(2,3)4/h6-7,10,13H,5,8-9H2,1-4H3/p+1
InChIKey
SDRYFBUJOCWNFY-UHFFFAOYSA-O
Compound name
trimethyl-[5-(methylcarbamoyloxy)-1,2,3,4-tetrahydronaphthalen-1-yl]azanium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

263.17596 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 264.18324 158.5
[M+Na]+ 286.16518 170.9
[M+NH4]+ 281.20978 168.0
[M+K]+ 302.13912 165.5
[M-H]- 262.16868 163.5
[M+Na-2H]- 284.15063 165.0
[M]+ 263.17541 162.0
[M]- 263.17651 162.0
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.