CID 44755

1-naphthamidine, n,n-diisopentyl-4-ethoxy-, hydrochloride

Structural Information

Molecular Formula
C23H34N2O
SMILES
CCOC1=CC=C(C2=CC=CC=C21)C(=N)N(CCC(C)C)CCC(C)C
InChI
InChI=1S/C23H34N2O/c1-6-26-22-12-11-21(19-9-7-8-10-20(19)22)23(24)25(15-13-17(2)3)16-14-18(4)5/h7-12,17-18,24H,6,13-16H2,1-5H3
InChIKey
PFJUZMPXFXAOCZ-UHFFFAOYSA-N
Compound name
4-ethoxy-N,N-bis(3-methylbutyl)naphthalene-1-carboximidamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

354.26712 Da
Monoisotopic Mass

6.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 355.274396 193.7
[M+Na]+ 377.256338 196.1
[M-H]- 353.259844 198.0
[M+NH4]+ 372.300943 207.7
[M+K]+ 393.230278 193.0
[M+H-H2O]+ 337.264380 185.1
[M+HCOO]- 399.265321 213.2
[M+CH3COO]- 413.280971 229.4
[M+Na-2H]- 375.241786 192.4
[M]+ 354.26657142 196.6
[M]- 354.26766858 196.6
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.