CID 82706225

Methoxy[(5-methylfuran-2-yl)methyl]amine

Structural Information

Molecular Formula
C7H11NO2
SMILES
CC1=CC=C(O1)CNOC
InChI
InChI=1S/C7H11NO2/c1-6-3-4-7(10-6)5-8-9-2/h3-4,8H,5H2,1-2H3
InChIKey
SXKCOMWMJSUKDF-UHFFFAOYSA-N
Compound name
N-methoxy-1-(5-methylfuran-2-yl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

141.07898 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 142.086256 127.0
[M+Na]+ 164.068198 135.1
[M-H]- 140.071704 131.6
[M+NH4]+ 159.112803 149.0
[M+K]+ 180.042138 135.8
[M+H-H2O]+ 124.076240 121.7
[M+HCOO]- 186.077181 153.4
[M+CH3COO]- 200.092831 175.2
[M+Na-2H]- 162.053646 134.6
[M]+ 141.07843142 129.9
[M]- 141.07952858 129.9
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.