CID 781301

1222781-70-5

Structural Information

Molecular Formula

C₁₉H₁₉NO

SMILES

COC1=CC=C(C=C1)CNCC2=CC=CC3=CC=CC=C32

InChI

InChI=1S/C19H19NO/c1-21-18-11-9-15(10-12-18)13-20-14-17-7-4-6-16-5-2-3-8-19(16)17/h2-12,20H,13-14H2,1H3

InChIKey

GIFYKGIODMXYNT-UHFFFAOYSA-N

Compound name

1-(4-methoxyphenyl)-N-(naphthalen-1-ylmethyl)methanamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 5
References: 5
Patents: 277.14667 Da
Monoisotopic Mass: 4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	278.15395	166.1
[M+Na]+	300.13589	182.2
[M+NH4]+	295.18049	176.3
[M+K]+	316.10983	171.8
[M-H]-	276.13939	173.2
[M+Na-2H]-	298.12134	176.8
[M]+	277.14612	170.7
[M]-	277.14722	170.7

Literature stripe

literature stripe

Patent stripe

patents stripe