CID 84337

14301-36-1

Structural Information

Molecular Formula
C11H15NO3
SMILES
COC1=C(C=C(C=C1)CCNC=O)OC
InChI
InChI=1S/C11H15NO3/c1-14-10-4-3-9(5-6-12-8-13)7-11(10)15-2/h3-4,7-8H,5-6H2,1-2H3,(H,12,13)
InChIKey
WUZNVFUYFDVUIC-UHFFFAOYSA-N
Compound name
N-[2-(3,4-dimethoxyphenyl)ethyl]formamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

115
Patents

209.1052 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 210.11248 144.3
[M+Na]+ 232.09442 152.0
[M-H]- 208.09792 148.2
[M+NH4]+ 227.13902 163.3
[M+K]+ 248.06836 150.6
[M+H-H2O]+ 192.10246 137.8
[M+HCOO]- 254.10340 170.1
[M+CH3COO]- 268.11905 189.7
[M+Na-2H]- 230.07987 150.4
[M]+ 209.10465 148.6
[M]- 209.10575 148.6
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