CID 60385

M-anisidine, n-methyl-4-((5-phenylpentyl)oxy)-

Structural Information

Molecular Formula
C19H25NO2
SMILES
CNC1=CC(=C(C=C1)OCCCCCC2=CC=CC=C2)OC
InChI
InChI=1S/C19H25NO2/c1-20-17-12-13-18(19(15-17)21-2)22-14-8-4-7-11-16-9-5-3-6-10-16/h3,5-6,9-10,12-13,15,20H,4,7-8,11,14H2,1-2H3
InChIKey
SMUNLOALKLJFLB-UHFFFAOYSA-N
Compound name
3-methoxy-N-methyl-4-(5-phenylpentoxy)aniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

299.18854 Da
Monoisotopic Mass

5.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 300.195816 173.0
[M+Na]+ 322.177758 178.2
[M-H]- 298.181264 178.9
[M+NH4]+ 317.222363 187.8
[M+K]+ 338.151698 174.2
[M+H-H2O]+ 282.185800 164.2
[M+HCOO]- 344.186741 197.1
[M+CH3COO]- 358.202391 208.2
[M+Na-2H]- 320.163206 177.2
[M]+ 299.18799142 176.6
[M]- 299.18908858 176.6
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

No patent data available for this compound.