CID 27225

M-anisidine, 4-((5-cyclohexylpentyl)oxy)-

Structural Information

Molecular Formula
C18H29NO2
SMILES
COC1=C(C=CC(=C1)N)OCCCCCC2CCCCC2
InChI
InChI=1S/C18H29NO2/c1-20-18-14-16(19)11-12-17(18)21-13-7-3-6-10-15-8-4-2-5-9-15/h11-12,14-15H,2-10,13,19H2,1H3
InChIKey
XJHYVNVVBMFVES-UHFFFAOYSA-N
Compound name
4-(5-cyclohexylpentoxy)-3-methoxyaniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

291.21982 Da
Monoisotopic Mass

5.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 292.22710 172.7
[M+Na]+ 314.20904 175.3
[M-H]- 290.21254 177.2
[M+NH4]+ 309.25364 187.4
[M+K]+ 330.18298 171.8
[M+H-H2O]+ 274.21708 164.2
[M+HCOO]- 336.21802 192.2
[M+CH3COO]- 350.23367 205.7
[M+Na-2H]- 312.19449 173.5
[M]+ 291.21927 170.8
[M]- 291.22037 170.8
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.