CID 964722

88741-50-8

Structural Information

Molecular Formula
C16H19NO2
SMILES
CNCC1=CC(=C(C=C1)OCC2=CC=CC=C2)OC
InChI
InChI=1S/C16H19NO2/c1-17-11-14-8-9-15(16(10-14)18-2)19-12-13-6-4-3-5-7-13/h3-10,17H,11-12H2,1-2H3
InChIKey
GXATYTAAZYUIDJ-UHFFFAOYSA-N
Compound name
1-(3-methoxy-4-phenylmethoxyphenyl)-N-methylmethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

6
References

9
Patents

257.14157 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 258.14885 160.4
[M+Na]+ 280.13079 174.6
[M+NH4]+ 275.17539 169.2
[M+K]+ 296.10473 166.1
[M-H]- 256.13429 165.9
[M+Na-2H]- 278.11624 170.0
[M]+ 257.14102 164.1
[M]- 257.14212 164.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe