CID 3025426

Urea, 1-(4-methoxy-1-naphthylmethyl)-

Structural Information

Molecular Formula
C13H14N2O2
SMILES
CNC(=O)NC1=CC=C(C2=CC=CC=C21)OC
InChI
InChI=1S/C13H14N2O2/c1-14-13(16)15-11-7-8-12(17-2)10-6-4-3-5-9(10)11/h3-8H,1-2H3,(H2,14,15,16)
InChIKey
HOTQCDOWCCRBHP-UHFFFAOYSA-N
Compound name
1-(4-methoxynaphthalen-1-yl)-3-methylurea
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

230.10553 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 231.112806 149.3
[M+Na]+ 253.094748 156.6
[M-H]- 229.098254 154.1
[M+NH4]+ 248.139353 168.1
[M+K]+ 269.068688 154.0
[M+H-H2O]+ 213.102790 142.4
[M+HCOO]- 275.103731 174.2
[M+CH3COO]- 289.119381 195.8
[M+Na-2H]- 251.080196 156.8
[M]+ 230.10498142 150.2
[M]- 230.10607858 150.2
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.