CID 44743

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

Structural Information

Molecular Formula
C21H30N2O
SMILES
CCCCN(CCCC)C(=N)C1=CC=C(C2=CC=CC=C21)OCC
InChI
InChI=1S/C21H30N2O/c1-4-7-15-23(16-8-5-2)21(22)19-13-14-20(24-6-3)18-12-10-9-11-17(18)19/h9-14,22H,4-8,15-16H2,1-3H3
InChIKey
OBORDMUWPMAZGU-UHFFFAOYSA-N
Compound name
N,N-dibutyl-4-ethoxynaphthalene-1-carboximidamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

326.2358 Da
Monoisotopic Mass

5.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 327.24308 183.9
[M+Na]+ 349.22502 187.6
[M-H]- 325.22852 188.4
[M+NH4]+ 344.26962 199.1
[M+K]+ 365.19896 183.9
[M+H-H2O]+ 309.23306 175.3
[M+HCOO]- 371.23400 206.1
[M+CH3COO]- 385.24965 221.7
[M+Na-2H]- 347.21047 186.0
[M]+ 326.23525 187.2
[M]- 326.23635 187.2
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.