CID 207786

30798-86-8

Structural Information

Molecular Formula
C27H42N2O
SMILES
CCCCCCCCCCOC1=CC=C(C2=CC=CC=C21)C(=N)N(C(C)C)C(C)C
InChI
InChI=1S/C27H42N2O/c1-6-7-8-9-10-11-12-15-20-30-26-19-18-25(23-16-13-14-17-24(23)26)27(28)29(21(2)3)22(4)5/h13-14,16-19,21-22,28H,6-12,15,20H2,1-5H3
InChIKey
KICXKPSKWAUCHY-UHFFFAOYSA-N
Compound name
4-decoxy-N,N-di(propan-2-yl)naphthalene-1-carboximidamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

410.3297 Da
Monoisotopic Mass

8.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 411.33698 212.2
[M+Na]+ 433.31892 212.7
[M-H]- 409.32242 215.5
[M+NH4]+ 428.36352 223.7
[M+K]+ 449.29286 208.7
[M+H-H2O]+ 393.32696 202.7
[M+HCOO]- 455.32790 230.2
[M+CH3COO]- 469.34355 241.1
[M+Na-2H]- 431.30437 208.6
[M]+ 410.32915 216.3
[M]- 410.33025 216.3
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.