CID 854306

Urea, 1-tert-butyl-3-(1-naphthyl)-

Structural Information

Molecular Formula
C15H18N2O
SMILES
CC(C)(C)NC(=O)NC1=CC=CC2=CC=CC=C21
InChI
InChI=1S/C15H18N2O/c1-15(2,3)17-14(18)16-13-10-6-8-11-7-4-5-9-12(11)13/h4-10H,1-3H3,(H2,16,17,18)
InChIKey
REHSGLABVNNHQU-UHFFFAOYSA-N
Compound name
1-tert-butyl-3-naphthalen-1-ylurea
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

0
Patents

242.1419 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 243.14918 156.1
[M+Na]+ 265.13112 162.2
[M-H]- 241.13462 160.5
[M+NH4]+ 260.17572 174.3
[M+K]+ 281.10506 158.9
[M+H-H2O]+ 225.13916 149.5
[M+HCOO]- 287.14010 178.4
[M+CH3COO]- 301.15575 198.2
[M+Na-2H]- 263.11657 163.9
[M]+ 242.14135 155.2
[M]- 242.14245 155.2
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

No patent data available for this compound.