CID 6888549

N'-(2-cl-6-f-benzylidene)3-(1,2,3,4-tetrahydro-9h-carbazol-9-yl)propanohydrazide

Structural Information

Molecular Formula
C22H21ClFN3O
SMILES
C1CCC2=C(C1)C3=CC=CC=C3N2CCC(=O)N/N=C/C4=C(C=CC=C4Cl)F
InChI
InChI=1S/C22H21ClFN3O/c23-18-8-5-9-19(24)17(18)14-25-26-22(28)12-13-27-20-10-3-1-6-15(20)16-7-2-4-11-21(16)27/h1,3,5-6,8-10,14H,2,4,7,11-13H2,(H,26,28)/b25-14+
InChIKey
YWNHWVCQNVBPIN-AFUMVMLFSA-N
Compound name
N-[(E)-(2-chloro-6-fluorophenyl)methylideneamino]-3-(1,2,3,4-tetrahydrocarbazol-9-yl)propanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

397.1357 Da
Monoisotopic Mass

4.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 398.14298 194.2
[M+Na]+ 420.12492 202.3
[M-H]- 396.12842 200.8
[M+NH4]+ 415.16952 208.7
[M+K]+ 436.09886 194.1
[M+H-H2O]+ 380.13296 184.0
[M+HCOO]- 442.13390 210.7
[M+CH3COO]- 456.14955 203.7
[M+Na-2H]- 418.11037 196.4
[M]+ 397.13515 196.0
[M]- 397.13625 196.0
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.