CID 52285

Benzoxazole, 2-diphenylmethyl-

Structural Information

Molecular Formula
C20H15NO
SMILES
C1=CC=C(C=C1)C(C2=CC=CC=C2)C3=NC4=CC=CC=C4O3
InChI
InChI=1S/C20H15NO/c1-3-9-15(10-4-1)19(16-11-5-2-6-12-16)20-21-17-13-7-8-14-18(17)22-20/h1-14,19H
InChIKey
FJZMMHGMSGFCDU-UHFFFAOYSA-N
Compound name
2-benzhydryl-1,3-benzoxazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

285.11536 Da
Monoisotopic Mass

5.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 286.12264 165.4
[M+Na]+ 308.10458 173.8
[M-H]- 284.10808 175.5
[M+NH4]+ 303.14918 180.4
[M+K]+ 324.07852 169.0
[M+H-H2O]+ 268.11262 156.2
[M+HCOO]- 330.11356 187.9
[M+CH3COO]- 344.12921 177.7
[M+Na-2H]- 306.09003 172.2
[M]+ 285.11481 166.9
[M]- 285.11591 166.9
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

No patent data available for this compound.