CID 44755

N,n-diisopentyl-4-ethoxy-1-naphthamidine 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]+ 355.27440 193.7
[M+Na]+ 377.25634 196.1
[M-H]- 353.25984 198.0
[M+NH4]+ 372.30094 207.7
[M+K]+ 393.23028 193.0
[M+H-H2O]+ 337.26438 185.1
[M+HCOO]- 399.26532 213.2
[M+CH3COO]- 413.28097 229.4
[M+Na-2H]- 375.24179 192.4
[M]+ 354.26657 196.6
[M]- 354.26767 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.