CID 27234

M-anisidine, 4-((5-o-tolylpentyl)oxy)-

Structural Information

Molecular Formula
C19H25NO2
SMILES
CC1=CC=CC=C1CCCCCOC2=C(C=C(C=C2)N)OC
InChI
InChI=1S/C19H25NO2/c1-15-8-5-6-10-16(15)9-4-3-7-13-22-18-12-11-17(20)14-19(18)21-2/h5-6,8,10-12,14H,3-4,7,9,13,20H2,1-2H3
InChIKey
LQKJJHVBQBFZAV-UHFFFAOYSA-N
Compound name
3-methoxy-4-[5-(2-methylphenyl)pentoxy]aniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

299.18854 Da
Monoisotopic Mass

4.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 300.19582 173.6
[M+Na]+ 322.17776 179.9
[M-H]- 298.18126 179.5
[M+NH4]+ 317.22236 188.6
[M+K]+ 338.15170 175.6
[M+H-H2O]+ 282.18580 165.1
[M+HCOO]- 344.18674 197.1
[M+CH3COO]- 358.20239 208.8
[M+Na-2H]- 320.16321 176.1
[M]+ 299.18799 176.8
[M]- 299.18909 176.8
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.