CID 20812588

N,2,2-trimethyl-1,3-dioxan-5-amine

Structural Information

Molecular Formula
C7H15NO2
SMILES
CC1(OCC(CO1)NC)C
InChI
InChI=1S/C7H15NO2/c1-7(2)9-4-6(8-3)5-10-7/h6,8H,4-5H2,1-3H3
InChIKey
IWOTZIOSJAUQSI-UHFFFAOYSA-N
Compound name
N,2,2-trimethyl-1,3-dioxan-5-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

12
Patents

145.11028 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 146.11756 130.6
[M+Na]+ 168.09950 141.3
[M+NH4]+ 163.14410 140.6
[M+K]+ 184.07344 134.8
[M-H]- 144.10300 135.5
[M+Na-2H]- 166.08495 136.4
[M]+ 145.10973 133.5
[M]- 145.11083 133.5
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

patents stripe