CID 84107679

2-(3-aminooxetan-3-yl)-n,n-dimethylacetamide

Structural Information

Molecular Formula
C7H14N2O2
SMILES
CN(C)C(=O)CC1(COC1)N
InChI
InChI=1S/C7H14N2O2/c1-9(2)6(10)3-7(8)4-11-5-7/h3-5,8H2,1-2H3
InChIKey
HVZUVBAZMQRYFI-UHFFFAOYSA-N
Compound name
2-(3-aminooxetan-3-yl)-N,N-dimethylacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

20
Patents

158.10553 Da
Monoisotopic Mass

-1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 159.11281 137.5
[M+Na]+ 181.09475 141.4
[M-H]- 157.09825 142.4
[M+NH4]+ 176.13935 151.9
[M+K]+ 197.06869 146.8
[M+H-H2O]+ 141.10279 126.9
[M+HCOO]- 203.10373 159.4
[M+CH3COO]- 217.11938 186.8
[M+Na-2H]- 179.08020 142.7
[M]+ 158.10498 145.6
[M]- 158.10608 145.6
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