CID 60185

M-anisidine, 4-(3-(p-methoxyphenoxy)propoxy)-

Structural Information

Molecular Formula
C17H21NO4
SMILES
COC1=CC=C(C=C1)OCCCOC2=C(C=C(C=C2)N)OC
InChI
InChI=1S/C17H21NO4/c1-19-14-5-7-15(8-6-14)21-10-3-11-22-16-9-4-13(18)12-17(16)20-2/h4-9,12H,3,10-11,18H2,1-2H3
InChIKey
CMOWKACUQPBKIP-UHFFFAOYSA-N
Compound name
3-methoxy-4-[3-(4-methoxyphenoxy)propoxy]aniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

303.14706 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 304.15434 170.4
[M+Na]+ 326.13628 177.1
[M-H]- 302.13978 176.6
[M+NH4]+ 321.18088 184.9
[M+K]+ 342.11022 174.6
[M+H-H2O]+ 286.14432 161.7
[M+HCOO]- 348.14526 194.9
[M+CH3COO]- 362.16091 207.0
[M+Na-2H]- 324.12173 174.0
[M]+ 303.14651 175.6
[M]- 303.14761 175.6
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.