CID 55219291

2-[2-(2-propynyloxy)ethoxy]ethylamine

Structural Information

Molecular Formula
C7H13NO2
SMILES
C#CCOCCOCCN
InChI
InChI=1S/C7H13NO2/c1-2-4-9-6-7-10-5-3-8/h1H,3-8H2
InChIKey
GVHLQHHQXWSDDM-UHFFFAOYSA-N
Compound name
2-(2-prop-2-ynoxyethoxy)ethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

206
Patents

143.09464 Da
Monoisotopic Mass

-0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 144.10192 127.8
[M+Na]+ 166.08386 136.1
[M-H]- 142.08736 126.8
[M+NH4]+ 161.12846 146.6
[M+K]+ 182.05780 135.2
[M+H-H2O]+ 126.09190 116.8
[M+HCOO]- 188.09284 146.5
[M+CH3COO]- 202.10849 185.2
[M+Na-2H]- 164.06931 133.1
[M]+ 143.09409 124.5
[M]- 143.09519 124.5
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