CID 44745

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

Structural Information

Molecular Formula
C20H28N2O
SMILES
CCCCN(CCCC)C(=N)C1=CC=C(C2=CC=CC=C21)OC
InChI
InChI=1S/C20H28N2O/c1-4-6-14-22(15-7-5-2)20(21)18-12-13-19(23-3)17-11-9-8-10-16(17)18/h8-13,21H,4-7,14-15H2,1-3H3
InChIKey
XTEOGYUONURFBH-UHFFFAOYSA-N
Compound name
N,N-dibutyl-4-methoxynaphthalene-1-carboximidamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

312.22015 Da
Monoisotopic Mass

5.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 313.22743 179.2
[M+Na]+ 335.20937 183.5
[M-H]- 311.21287 184.0
[M+NH4]+ 330.25397 195.1
[M+K]+ 351.18331 180.0
[M+H-H2O]+ 295.21741 170.9
[M+HCOO]- 357.21835 201.8
[M+CH3COO]- 371.23400 218.7
[M+Na-2H]- 333.19482 182.0
[M]+ 312.21960 182.3
[M]- 312.22070 182.3
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.