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]+ 142.08626 127.0
[M+Na]+ 164.06820 135.1
[M-H]- 140.07170 131.6
[M+NH4]+ 159.11280 149.0
[M+K]+ 180.04214 135.8
[M+H-H2O]+ 124.07624 121.7
[M+HCOO]- 186.07718 153.4
[M+CH3COO]- 200.09283 175.2
[M+Na-2H]- 162.05365 134.6
[M]+ 141.07843 129.9
[M]- 141.07953 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.