CID 375098

Nsc654109

Structural Information

Molecular Formula
C15H10ClNO
SMILES
C1=CC=C2C(=C1)C=CC(=NC3=CC=C(C=C3)Cl)O2
InChI
InChI=1S/C15H10ClNO/c16-12-6-8-13(9-7-12)17-15-10-5-11-3-1-2-4-14(11)18-15/h1-10H
InChIKey
QDTZMKQGBQWYOD-UHFFFAOYSA-N
Compound name
N-(4-chlorophenyl)chromen-2-imine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

255.04509 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 256.052366 154.0
[M+Na]+ 278.034308 164.5
[M-H]- 254.037814 163.8
[M+NH4]+ 273.078913 172.0
[M+K]+ 294.008248 159.7
[M+H-H2O]+ 238.042350 146.7
[M+HCOO]- 300.043291 175.2
[M+CH3COO]- 314.058941 167.9
[M+Na-2H]- 276.019756 164.1
[M]+ 255.04454142 157.7
[M]- 255.04563858 157.7
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.