CID 10889160

3h-benzo[f]chromene-2-carbaldehyde

Structural Information

Molecular Formula
C14H10O2
SMILES
C1C(=CC2=C(O1)C=CC3=CC=CC=C32)C=O
InChI
InChI=1S/C14H10O2/c15-8-10-7-13-12-4-2-1-3-11(12)5-6-14(13)16-9-10/h1-8H,9H2
InChIKey
BIHHFQLXQICCJQ-UHFFFAOYSA-N
Compound name
3H-benzo[f]chromene-2-carbaldehyde
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

8
Patents

210.06808 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 211.07536 141.2
[M+Na]+ 233.05730 150.6
[M-H]- 209.06080 147.6
[M+NH4]+ 228.10190 160.9
[M+K]+ 249.03124 147.7
[M+H-H2O]+ 193.06534 134.6
[M+HCOO]- 255.06628 162.2
[M+CH3COO]- 269.08193 155.1
[M+Na-2H]- 231.04275 151.6
[M]+ 210.06753 142.5
[M]- 210.06863 142.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe