CID 781614

1-(naphthalen-1-yl)-3-phenethylurea

Structural Information

Molecular Formula
C19H18N2O
SMILES
C1=CC=C(C=C1)CCNC(=O)NC2=CC=CC3=CC=CC=C32
InChI
InChI=1S/C19H18N2O/c22-19(20-14-13-15-7-2-1-3-8-15)21-18-12-6-10-16-9-4-5-11-17(16)18/h1-12H,13-14H2,(H2,20,21,22)
InChIKey
SEFKRPHYWRGFJI-UHFFFAOYSA-N
Compound name
1-naphthalen-1-yl-3-(2-phenylethyl)urea
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

290.1419 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 291.14918 169.8
[M+Na]+ 313.13112 183.8
[M+NH4]+ 308.17572 178.9
[M+K]+ 329.10506 174.4
[M-H]- 289.13462 176.5
[M+Na-2H]- 311.11657 179.8
[M]+ 290.14135 173.7
[M]- 290.14245 173.7
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.