CID 45054821

N'-(3-chlorobenzylidene)hexadecanohydrazide

Structural Information

Molecular Formula
C23H37ClN2O
SMILES
CCCCCCCCCCCCCCCC(=O)N/N=C/C1=CC(=CC=C1)Cl
InChI
InChI=1S/C23H37ClN2O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-18-23(27)26-25-20-21-16-15-17-22(24)19-21/h15-17,19-20H,2-14,18H2,1H3,(H,26,27)/b25-20+
InChIKey
HPOWVOFNRWZZMW-LKUDQCMESA-N
Compound name
N-[(E)-(3-chlorophenyl)methylideneamino]hexadecanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

392.25943 Da
Monoisotopic Mass

9.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 393.26671 204.0
[M+Na]+ 415.24865 206.2
[M-H]- 391.25215 206.4
[M+NH4]+ 410.29325 216.4
[M+K]+ 431.22259 199.4
[M+H-H2O]+ 375.25669 195.5
[M+HCOO]- 437.25763 222.4
[M+CH3COO]- 451.27328 230.3
[M+Na-2H]- 413.23410 203.2
[M]+ 392.25888 211.1
[M]- 392.25998 211.1
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.