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

4
Patents

141.07898 Da
Monoisotopic Mass

-0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 142.08626 128.7
[M+Na]+ 164.06820 135.7
[M-H]- 140.07170 132.6
[M+NH4]+ 159.11280 150.1
[M+K]+ 180.04214 136.4
[M+H-H2O]+ 124.07624 123.2
[M+HCOO]- 186.07718 153.5
[M+CH3COO]- 200.09283 174.3
[M+Na-2H]- 162.05365 134.6
[M]+ 141.07843 129.6
[M]- 141.07953 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