CID 66970

2-ethoxyethylamine

Structural Information

Molecular Formula
C4H11NO
SMILES
CCOCCN
InChI
InChI=1S/C4H11NO/c1-2-6-4-3-5/h2-5H2,1H3
InChIKey
BPGIOCZAQDIBPI-UHFFFAOYSA-N
Compound name
2-ethoxyethanamine
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

5
References

9631
Patents

89.08406 Da
Monoisotopic Mass

-0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 90.091336 117.0
[M+Na]+ 112.073278 124.2
[M-H]- 88.076784 117.0
[M+NH4]+ 107.117883 140.3
[M+K]+ 128.047218 124.6
[M+H-H2O]+ 72.081320 112.6
[M+HCOO]- 134.082261 142.1
[M+CH3COO]- 148.097911 167.2
[M+Na-2H]- 110.058726 124.3
[M]+ 89.08351142 117.1
[M]- 89.08460858 117.1
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