CID 261273

2-(prop-2-en-1-yloxy)ethan-1-amine

Structural Information

Molecular Formula
C5H11NO
SMILES
C=CCOCCN
InChI
InChI=1S/C5H11NO/c1-2-4-7-5-3-6/h2H,1,3-6H2
InChIKey
RSHBLZQBIVURPD-UHFFFAOYSA-N
Compound name
2-prop-2-enoxyethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

139
Patents

101.08406 Da
Monoisotopic Mass

-0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 102.091336 120.2
[M+Na]+ 124.073278 127.2
[M-H]- 100.076784 120.0
[M+NH4]+ 119.117883 142.9
[M+K]+ 140.047218 126.7
[M+H-H2O]+ 84.081320 115.6
[M+HCOO]- 146.082261 145.1
[M+CH3COO]- 160.097911 169.3
[M+Na-2H]- 122.058726 127.0
[M]+ 101.08351142 120.0
[M]- 101.08460858 120.0
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