CID 70175

2,2-diphenyltetrahydrofuran

Structural Information

Molecular Formula
C16H16O
SMILES
C1CC(OC1)(C2=CC=CC=C2)C3=CC=CC=C3
InChI
InChI=1S/C16H16O/c1-3-8-14(9-4-1)16(12-7-13-17-16)15-10-5-2-6-11-15/h1-6,8-11H,7,12-13H2
InChIKey
ONRSPOWNRLCCGF-UHFFFAOYSA-N
Compound name
2,2-diphenyloxolane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

5
References

36
Patents

224.12012 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 225.12740 150.6
[M+Na]+ 247.10934 156.9
[M-H]- 223.11284 160.6
[M+NH4]+ 242.15394 170.4
[M+K]+ 263.08328 154.1
[M+H-H2O]+ 207.11738 143.3
[M+HCOO]- 269.11832 173.1
[M+CH3COO]- 283.13397 163.6
[M+Na-2H]- 245.09479 156.9
[M]+ 224.11957 148.0
[M]- 224.12067 148.0
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