CID 9834320

474024-38-9

Structural Information

Molecular Formula
C13H9NO2
SMILES
C1COC(=C2C=C(C3=CC=CC=C32)C#N)O1
InChI
InChI=1S/C13H9NO2/c14-8-9-7-12(13-15-5-6-16-13)11-4-2-1-3-10(9)11/h1-4,7H,5-6H2
InChIKey
LOFHCHIYFDFUNK-UHFFFAOYSA-N
Compound name
3-(1,3-dioxolan-2-ylidene)indene-1-carbonitrile
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

26
Patents

211.06332 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 212.07060 148.8
[M+Na]+ 234.05254 160.9
[M+NH4]+ 229.09714 154.5
[M+K]+ 250.02648 154.5
[M-H]- 210.05604 147.0
[M+Na-2H]- 232.03799 151.2
[M]+ 211.06277 149.2
[M]- 211.06387 149.2
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