CID 84478

14496-34-5

Structural Information

Molecular Formula
C7H11NO
SMILES
CN(C)CC1=CC=CO1
InChI
InChI=1S/C7H11NO/c1-8(2)6-7-4-3-5-9-7/h3-5H,6H2,1-2H3
InChIKey
VFIAOIVGTFADLM-UHFFFAOYSA-N
Compound name
1-(furan-2-yl)-N,N-dimethylmethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

312
Patents

125.08406 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 126.091336 124.7
[M+Na]+ 148.073278 132.2
[M-H]- 124.076784 130.5
[M+NH4]+ 143.117883 147.8
[M+K]+ 164.047218 133.8
[M+H-H2O]+ 108.081320 119.2
[M+HCOO]- 170.082261 151.5
[M+CH3COO]- 184.097911 175.7
[M+Na-2H]- 146.058726 132.2
[M]+ 125.08351142 127.1
[M]- 125.08460858 127.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe