CID 106164

Jasmea

Structural Information

Molecular Formula
C23H27NO2
SMILES
CCCCCCC(=CC1=CC=CC=C1)C=NC2=CC=CC=C2C(=O)OC
InChI
InChI=1S/C23H27NO2/c1-3-4-5-7-14-20(17-19-12-8-6-9-13-19)18-24-22-16-11-10-15-21(22)23(25)26-2/h6,8-13,15-18H,3-5,7,14H2,1-2H3
InChIKey
XTFDJRLNMKZPCR-UHFFFAOYSA-N
Compound name
methyl 2-(2-benzylideneoctylideneamino)benzoate
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

349.2042 Da
Monoisotopic Mass

6.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 350.21148 189.2
[M+Na]+ 372.19342 201.5
[M+NH4]+ 367.23802 196.0
[M+K]+ 388.16736 192.2
[M-H]- 348.19692 193.6
[M+Na-2H]- 370.17887 196.7
[M]+ 349.20365 192.1
[M]- 349.20475 192.1
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.