CID 203377

Rp 2222

Structural Information

Molecular Formula
C12H23NO2
SMILES
CC(=O)OC1C(C(C1(C)C)N(C)C)(C)C
InChI
InChI=1S/C12H23NO2/c1-8(14)15-10-11(2,3)9(13(6)7)12(10,4)5/h9-10H,1-7H3
InChIKey
OFLZIEXBMCBVGL-UHFFFAOYSA-N
Compound name
[3-(dimethylamino)-2,2,4,4-tetramethylcyclobutyl] acetate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

213.17288 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 214.180156 150.8
[M+Na]+ 236.162098 157.3
[M-H]- 212.165604 156.5
[M+NH4]+ 231.206703 168.1
[M+K]+ 252.136038 161.1
[M+H-H2O]+ 196.170140 143.1
[M+HCOO]- 258.171081 171.8
[M+CH3COO]- 272.186731 200.5
[M+Na-2H]- 234.147546 153.0
[M]+ 213.17233142 163.5
[M]- 213.17342858 163.5
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.