CID 11948150

Schembl12155419

Structural Information

Molecular Formula
C24H20N2O3
SMILES
CC1=CC=C(C=C1)N=CC2=C(C3=CC=CC=C3OC2=O)NC4=CC=C(C=C4)OC
InChI
InChI=1S/C24H20N2O3/c1-16-7-9-17(10-8-16)25-15-21-23(26-18-11-13-19(28-2)14-12-18)20-5-3-4-6-22(20)29-24(21)27/h3-15,26H,1-2H3
InChIKey
QISABVAPLQABTQ-UHFFFAOYSA-N
Compound name
4-(4-methoxyanilino)-3-[(4-methylphenyl)iminomethyl]chromen-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

384.1474 Da
Monoisotopic Mass

5.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 385.15468 194.0
[M+Na]+ 407.13662 202.5
[M-H]- 383.14012 206.9
[M+NH4]+ 402.18122 205.0
[M+K]+ 423.11056 198.0
[M+H-H2O]+ 367.14466 182.6
[M+HCOO]- 429.14560 219.0
[M+CH3COO]- 443.16125 205.0
[M+Na-2H]- 405.12207 200.2
[M]+ 384.14685 198.0
[M]- 384.14795 198.0
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

patents stripe