CID 24832971

Erl 377

Structural Information

Molecular Formula
C14H26NO2
SMILES
CC[N+](C)(CC)CC(=O)OC1CC2CCC1C2
InChI
InChI=1S/C14H26NO2/c1-4-15(3,5-2)10-14(16)17-13-9-11-6-7-12(13)8-11/h11-13H,4-10H2,1-3H3/q+1
InChIKey
WMLUENGXBYZGSW-UHFFFAOYSA-N
Compound name
[2-(2-bicyclo[2.2.1]heptanyloxy)-2-oxoethyl]-diethyl-methylazanium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

240.19635 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 241.20363 160.7
[M+Na]+ 263.18557 165.1
[M-H]- 239.18907 164.3
[M+NH4]+ 258.23017 183.8
[M+K]+ 279.15951 158.6
[M+H-H2O]+ 223.19361 158.9
[M+HCOO]- 285.19455 180.3
[M+CH3COO]- 299.21020 191.9
[M+Na-2H]- 261.17102 165.2
[M]+ 240.19580 160.9
[M]- 240.19690 160.9
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.