CID 6888778

452089-93-9

Structural Information

Molecular Formula
C22H23N3O2
SMILES
C1CCC2=C(C1)C3=CC=CC=C3N2CCC(=O)N/N=C/C4=CC(=CC=C4)O
InChI
InChI=1S/C22H23N3O2/c26-17-7-5-6-16(14-17)15-23-24-22(27)12-13-25-20-10-3-1-8-18(20)19-9-2-4-11-21(19)25/h1,3,5-8,10,14-15,26H,2,4,9,11-13H2,(H,24,27)/b23-15+
InChIKey
ZYOLWHDNJSQQFR-HZHRSRAPSA-N
Compound name
N-[(E)-(3-hydroxyphenyl)methylideneamino]-3-(1,2,3,4-tetrahydrocarbazol-9-yl)propanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

361.17902 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 362.186296 184.1
[M+Na]+ 384.168238 189.7
[M-H]- 360.171744 190.7
[M+NH4]+ 379.212843 198.1
[M+K]+ 400.142178 183.5
[M+H-H2O]+ 344.176280 174.5
[M+HCOO]- 406.177221 205.0
[M+CH3COO]- 420.192871 193.6
[M+Na-2H]- 382.153686 188.3
[M]+ 361.17847142 183.7
[M]- 361.17956858 183.7
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.