CID 88073

N,n-dimethyl-1,3-dioxan-2-amine

Structural Information

Molecular Formula
C6H13NO2
SMILES
CN(C)C1OCCCO1
InChI
InChI=1S/C6H13NO2/c1-7(2)6-8-4-3-5-9-6/h6H,3-5H2,1-2H3
InChIKey
SSGCBTSVDLLNIP-UHFFFAOYSA-N
Compound name
N,N-dimethyl-1,3-dioxan-2-amine
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

24
Patents

131.09464 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 132.101916 127.4
[M+Na]+ 154.083858 132.3
[M-H]- 130.087364 133.1
[M+NH4]+ 149.128463 146.9
[M+K]+ 170.057798 136.0
[M+H-H2O]+ 114.091900 121.6
[M+HCOO]- 176.092841 148.7
[M+CH3COO]- 190.108491 175.8
[M+Na-2H]- 152.069306 135.6
[M]+ 131.09409142 126.5
[M]- 131.09518858 126.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe