CID 22952203

(2,4-dimethoxyphenyl)(4-methoxyphenyl)methanamine hydrochloride

Structural Information

Molecular Formula
C16H19NO3
SMILES
COC1=CC=C(C=C1)C(C2=C(C=C(C=C2)OC)OC)N
InChI
InChI=1S/C16H19NO3/c1-18-12-6-4-11(5-7-12)16(17)14-9-8-13(19-2)10-15(14)20-3/h4-10,16H,17H2,1-3H3
InChIKey
BLECVMLKEBWWJQ-UHFFFAOYSA-N
Compound name
(2,4-dimethoxyphenyl)-(4-methoxyphenyl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

15
Patents

273.1365 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 274.14378 163.5
[M+Na]+ 296.12572 176.9
[M+NH4]+ 291.17032 171.4
[M+K]+ 312.09966 170.2
[M-H]- 272.12922 168.2
[M+Na-2H]- 294.11117 171.6
[M]+ 273.13595 166.8
[M]- 273.13705 166.8
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

patents stripe