CID 218529

Urea, n-1-naphthalenyl-n'-(1-propylbutyl)-

Structural Information

Molecular Formula
C18H24N2O
SMILES
CCCC(CCC)NC(=O)NC1=CC=CC2=CC=CC=C21
InChI
InChI=1S/C18H24N2O/c1-3-8-15(9-4-2)19-18(21)20-17-13-7-11-14-10-5-6-12-16(14)17/h5-7,10-13,15H,3-4,8-9H2,1-2H3,(H2,19,20,21)
InChIKey
CMXACVYTDQYAMT-UHFFFAOYSA-N
Compound name
1-heptan-4-yl-3-naphthalen-1-ylurea
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

284.18887 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 285.19615 170.0
[M+Na]+ 307.17809 173.8
[M-H]- 283.18159 173.4
[M+NH4]+ 302.22269 186.1
[M+K]+ 323.15203 169.9
[M+H-H2O]+ 267.18613 162.2
[M+HCOO]- 329.18707 191.8
[M+CH3COO]- 343.20272 208.4
[M+Na-2H]- 305.16354 174.1
[M]+ 284.18832 170.0
[M]- 284.18942 170.0
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.