CID 6437750

9-octadecenamide, n-(9-ethyl-9h-carbazol-3-yl)-, (9z)-

Structural Information

Molecular Formula
C32H46N2O
SMILES
CCCCCCCC/C=C\CCCCCCCC(=O)NC1=CC2=C(C=C1)N(C3=CC=CC=C32)CC
InChI
InChI=1S/C32H46N2O/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-23-32(35)33-27-24-25-31-29(26-27)28-21-19-20-22-30(28)34(31)4-2/h11-12,19-22,24-26H,3-10,13-18,23H2,1-2H3,(H,33,35)/b12-11-
InChIKey
HJBKRORLQKPAFB-QXMHVHEDSA-N
Compound name
(Z)-N-(9-ethylcarbazol-3-yl)octadec-9-enamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

474.36102 Da
Monoisotopic Mass

10.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 475.36830 230.0
[M+Na]+ 497.35024 232.8
[M-H]- 473.35374 231.5
[M+NH4]+ 492.39484 240.3
[M+K]+ 513.32418 223.6
[M+H-H2O]+ 457.35828 219.5
[M+HCOO]- 519.35922 247.4
[M+CH3COO]- 533.37487 245.1
[M+Na-2H]- 495.33569 227.2
[M]+ 474.36047 237.3
[M]- 474.36157 237.3
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.