CID 16783274

1-(furan-2-yl)-2-methoxyethan-1-amine

Structural Information

Molecular Formula
C7H11NO2
SMILES
COCC(C1=CC=CO1)N
InChI
InChI=1S/C7H11NO2/c1-9-5-6(8)7-3-2-4-10-7/h2-4,6H,5,8H2,1H3
InChIKey
MQWDDJAFRMXKAW-UHFFFAOYSA-N
Compound name
1-(furan-2-yl)-2-methoxyethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

141.07898 Da
Monoisotopic Mass

-0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 142.086256 128.7
[M+Na]+ 164.068198 135.7
[M-H]- 140.071704 132.6
[M+NH4]+ 159.112803 150.1
[M+K]+ 180.042138 136.4
[M+H-H2O]+ 124.076240 123.2
[M+HCOO]- 186.077181 153.5
[M+CH3COO]- 200.092831 174.3
[M+Na-2H]- 162.053646 134.6
[M]+ 141.07843142 129.6
[M]- 141.07952858 129.6
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