CID 21966624

4-methoxybut-2-en-1-amine

Structural Information

Molecular Formula
C5H11NO
SMILES
COC/C=C/CN
InChI
InChI=1S/C5H11NO/c1-7-5-3-2-4-6/h2-3H,4-6H2,1H3/b3-2+
InChIKey
FFDXRXAPBWZNPY-NSCUHMNNSA-N
Compound name
(E)-4-methoxybut-2-en-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

101.08406 Da
Monoisotopic Mass

-0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 102.09134 119.9
[M+Na]+ 124.07328 129.7
[M+NH4]+ 119.11788 128.0
[M+K]+ 140.04722 124.1
[M-H]- 100.07678 119.9
[M+Na-2H]- 122.05873 124.0
[M]+ 101.08351 121.0
[M]- 101.08461 121.0
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

No patent data available for this compound.