CID 9579224

1-(1-adamantyl)-n-[(e)-cinnamyl]oxy-1-phenyl-methanimine

Structural Information

Molecular Formula
C26H29NO
SMILES
C1C2CC3CC1CC(C2)(C3)/C(=N/OC/C=C/C4=CC=CC=C4)/C5=CC=CC=C5
InChI
InChI=1S/C26H29NO/c1-3-8-20(9-4-1)10-7-13-28-27-25(24-11-5-2-6-12-24)26-17-21-14-22(18-26)16-23(15-21)19-26/h1-12,21-23H,13-19H2/b10-7+,27-25+
InChIKey
CFWDDWBPDKWOJA-LRGMGXDQSA-N
Compound name
(Z)-1-(1-adamantyl)-1-phenyl-N-[(E)-3-phenylprop-2-enoxy]methanimine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

371.2249 Da
Monoisotopic Mass

6.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 372.23218 184.7
[M+Na]+ 394.21412 183.0
[M-H]- 370.21762 185.5
[M+NH4]+ 389.25872 202.5
[M+K]+ 410.18806 176.8
[M+H-H2O]+ 354.22216 172.6
[M+HCOO]- 416.22310 192.0
[M+CH3COO]- 430.23875 190.0
[M+Na-2H]- 392.19957 192.9
[M]+ 371.22435 183.1
[M]- 371.22545 183.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.