CID 3068340

6-cyano-6h-dibenzo(b,d)pyran

Structural Information

Molecular Formula
C14H9NO
SMILES
C1=CC=C2C(=C1)C(OC3=CC=CC=C23)C#N
InChI
InChI=1S/C14H9NO/c15-9-14-12-7-2-1-5-10(12)11-6-3-4-8-13(11)16-14/h1-8,14H
InChIKey
WQHAZYSCIDMBTQ-UHFFFAOYSA-N
Compound name
6H-benzo[c]chromene-6-carbonitrile
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

207.06842 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 208.07570 150.4
[M+Na]+ 230.05764 165.7
[M+NH4]+ 225.10224 157.4
[M+K]+ 246.03158 153.9
[M-H]- 206.06114 148.6
[M+Na-2H]- 228.04309 155.1
[M]+ 207.06787 151.6
[M]- 207.06897 151.6
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