CID 92445

Bis(2,2-dimethoxyethyl)amine

Structural Information

Molecular Formula
C8H19NO4
SMILES
COC(CNCC(OC)OC)OC
InChI
InChI=1S/C8H19NO4/c1-10-7(11-2)5-9-6-8(12-3)13-4/h7-9H,5-6H2,1-4H3
InChIKey
OMMFDGDFQAYQFM-UHFFFAOYSA-N
Compound name
N-(2,2-dimethoxyethyl)-2,2-dimethoxyethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

19
Patents

193.13141 Da
Monoisotopic Mass

-0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 194.13869 144.4
[M+Na]+ 216.12063 149.3
[M-H]- 192.12413 144.3
[M+NH4]+ 211.16523 163.5
[M+K]+ 232.09457 151.4
[M+H-H2O]+ 176.12867 138.5
[M+HCOO]- 238.12961 167.5
[M+CH3COO]- 252.14526 187.7
[M+Na-2H]- 214.10608 148.1
[M]+ 193.13086 150.1
[M]- 193.13196 150.1
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