CID 138319622

1858221-50-7

Structural Information

Molecular Formula
C20H33NO2
SMILES
CCCCCCCCCCOCCCN=CC1=CC=CC=C1O
InChI
InChI=1S/C20H33NO2/c1-2-3-4-5-6-7-8-11-16-23-17-12-15-21-18-19-13-9-10-14-20(19)22/h9-10,13-14,18,22H,2-8,11-12,15-17H2,1H3
InChIKey
HDZYCSDNRNZWAM-UHFFFAOYSA-N
Compound name
2-(3-decoxypropyliminomethyl)phenol
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

319.25113 Da
Monoisotopic Mass

5.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 320.258406 183.0
[M+Na]+ 342.240348 185.9
[M-H]- 318.243854 184.6
[M+NH4]+ 337.284953 197.2
[M+K]+ 358.214288 181.7
[M+H-H2O]+ 302.248390 174.6
[M+HCOO]- 364.249331 205.5
[M+CH3COO]- 378.264981 213.0
[M+Na-2H]- 340.225796 184.8
[M]+ 319.25058142 188.6
[M]- 319.25167858 188.6
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.