CID 35716

1-naphthamidine, n,n-dipropyl-4-octyloxy-, monohydrochloride

Structural Information

Molecular Formula
C25H38N2O
SMILES
CCCCCCCCOC1=CC=C(C2=CC=CC=C21)C(=N)N(CCC)CCC
InChI
InChI=1S/C25H38N2O/c1-4-7-8-9-10-13-20-28-24-17-16-23(21-14-11-12-15-22(21)24)25(26)27(18-5-2)19-6-3/h11-12,14-17,26H,4-10,13,18-20H2,1-3H3
InChIKey
AUDHJYBGIAMWOA-UHFFFAOYSA-N
Compound name
4-octoxy-N,N-dipropylnaphthalene-1-carboximidamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

382.2984 Da
Monoisotopic Mass

7.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 383.305676 202.2
[M+Na]+ 405.287618 204.1
[M-H]- 381.291124 205.8
[M+NH4]+ 400.332223 215.0
[M+K]+ 421.261558 199.5
[M+H-H2O]+ 365.295660 192.7
[M+HCOO]- 427.296601 222.9
[M+CH3COO]- 441.312251 233.5
[M+Na-2H]- 403.273066 202.1
[M]+ 382.29785142 206.9
[M]- 382.29894858 206.9
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.