CID 13148195

Hexahydro-n,n,n',n'-tetraethyl-1,4,7-oxadiazonine-4,7-diethanamine

Structural Information

Molecular Formula
C18H40N4O
SMILES
CCN(CC)CCN1CCN(CCOCC1)CCN(CC)CC
InChI
InChI=1S/C18H40N4O/c1-5-19(6-2)9-11-21-13-14-22(16-18-23-17-15-21)12-10-20(7-3)8-4/h5-18H2,1-4H3
InChIKey
NATVFOMWUXZQFC-UHFFFAOYSA-N
Compound name
2-[7-[2-(diethylamino)ethyl]-1,4,7-oxadiazonan-4-yl]-N,N-diethylethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

328.32022 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 329.32750 194.8
[M+Na]+ 351.30944 196.6
[M-H]- 327.31294 194.7
[M+NH4]+ 346.35404 194.9
[M+K]+ 367.28338 194.5
[M+H-H2O]+ 311.31748 186.2
[M+HCOO]- 373.31842 195.6
[M+CH3COO]- 387.33407 196.2
[M+Na-2H]- 349.29489 197.1
[M]+ 328.31967 195.1
[M]- 328.32077 195.1
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.