CID 45899

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

Structural Information

Molecular Formula
C22H32N2O
SMILES
CCCCCN(CCCCC)C(=N)C1=CC=C(C2=CC=CC=C21)OC
InChI
InChI=1S/C22H32N2O/c1-4-6-10-16-24(17-11-7-5-2)22(23)20-14-15-21(25-3)19-13-9-8-12-18(19)20/h8-9,12-15,23H,4-7,10-11,16-17H2,1-3H3
InChIKey
HQPUWJAOORWVCY-UHFFFAOYSA-N
Compound name
4-methoxy-N,N-dipentylnaphthalene-1-carboximidamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

340.25146 Da
Monoisotopic Mass

6.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 341.25874 188.5
[M+Na]+ 363.24068 191.8
[M-H]- 339.24418 192.8
[M+NH4]+ 358.28528 203.1
[M+K]+ 379.21462 187.8
[M+H-H2O]+ 323.24872 179.7
[M+HCOO]- 385.24966 210.3
[M+CH3COO]- 399.26531 224.7
[M+Na-2H]- 361.22613 190.1
[M]+ 340.25091 192.2
[M]- 340.25201 192.2
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.