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

126
Patents

101.08406 Da
Monoisotopic Mass

-0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 102.09134 120.2
[M+Na]+ 124.07328 127.2
[M-H]- 100.07678 120.0
[M+NH4]+ 119.11788 142.9
[M+K]+ 140.04722 126.7
[M+H-H2O]+ 84.081320 115.6
[M+HCOO]- 146.08226 145.1
[M+CH3COO]- 160.09791 169.3
[M+Na-2H]- 122.05873 127.0
[M]+ 101.08351 120.0
[M]- 101.08461 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