CID 106075

67906-30-3

Structural Information

Molecular Formula
C25H17N3O2
SMILES
C1=CC=C(C=C1)C2=CC3=C(C=C(C=C3)N=NC4=C(C=CC5=CC=CC=C54)N)OC2=O
InChI
InChI=1S/C25H17N3O2/c26-22-13-11-17-8-4-5-9-20(17)24(22)28-27-19-12-10-18-14-21(16-6-2-1-3-7-16)25(29)30-23(18)15-19/h1-15H,26H2
InChIKey
WHDOBXLBYBWVMQ-UHFFFAOYSA-N
Compound name
7-[(2-aminonaphthalen-1-yl)diazenyl]-3-phenylchromen-2-one
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

391.13208 Da
Monoisotopic Mass

5.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 392.13936 194.4
[M+Na]+ 414.12130 204.3
[M-H]- 390.12480 209.0
[M+NH4]+ 409.16590 205.9
[M+K]+ 430.09524 199.0
[M+H-H2O]+ 374.12934 182.2
[M+HCOO]- 436.13028 221.4
[M+CH3COO]- 450.14593 205.8
[M+Na-2H]- 412.10675 203.8
[M]+ 391.13153 197.4
[M]- 391.13263 197.4
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.