CID 35477

N,n-dibutyl-4-heptyloxy-1-naphthamidine hydrochloride

Structural Information

Molecular Formula
C26H40N2O
SMILES
CCCCCCCOC1=CC=C(C2=CC=CC=C21)C(=N)N(CCCC)CCCC
InChI
InChI=1S/C26H40N2O/c1-4-7-10-11-14-21-29-25-18-17-24(22-15-12-13-16-23(22)25)26(27)28(19-8-5-2)20-9-6-3/h12-13,15-18,27H,4-11,14,19-21H2,1-3H3
InChIKey
BFXHAVWWCMWPJE-UHFFFAOYSA-N
Compound name
N,N-dibutyl-4-heptoxynaphthalene-1-carboximidamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

396.31406 Da
Monoisotopic Mass

8.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 397.32134 206.1
[M+Na]+ 419.30328 216.1
[M+NH4]+ 414.34788 212.9
[M+K]+ 435.27722 206.2
[M-H]- 395.30678 209.9
[M+Na-2H]- 417.28873 210.0
[M]+ 396.31351 208.5
[M]- 396.31461 208.5
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.