CID 207788

30798-90-4

Structural Information

Molecular Formula
C28H44N2O
SMILES
CCCCCCCCCCCOC1=CC=C(C2=CC=CC=C21)C(=N)N(C(C)C)C(C)C
InChI
InChI=1S/C28H44N2O/c1-6-7-8-9-10-11-12-13-16-21-31-27-20-19-26(24-17-14-15-18-25(24)27)28(29)30(22(2)3)23(4)5/h14-15,17-20,22-23,29H,6-13,16,21H2,1-5H3
InChIKey
SLOBVCKEVUMCIJ-UHFFFAOYSA-N
Compound name
N,N-di(propan-2-yl)-4-undecoxynaphthalene-1-carboximidamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

424.34537 Da
Monoisotopic Mass

9.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 425.35265 216.7
[M+Na]+ 447.33459 216.8
[M-H]- 423.33809 219.9
[M+NH4]+ 442.37919 227.7
[M+K]+ 463.30853 212.6
[M+H-H2O]+ 407.34263 207.1
[M+HCOO]- 469.34357 234.3
[M+CH3COO]- 483.35922 244.0
[M+Na-2H]- 445.32004 212.7
[M]+ 424.34482 221.2
[M]- 424.34592 221.2
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.