CID 10468522

500372-25-8

Structural Information

Molecular Formula
C19H15NO
SMILES
C1=CC=C(C=C1)COC(C#N)C2=CC3=CC=CC=C3C=C2
InChI
InChI=1S/C19H15NO/c20-13-19(21-14-15-6-2-1-3-7-15)18-11-10-16-8-4-5-9-17(16)12-18/h1-12,19H,14H2
InChIKey
SLMXQIWKVZNVSR-UHFFFAOYSA-N
Compound name
2-naphthalen-2-yl-2-phenylmethoxyacetonitrile
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

273.11536 Da
Monoisotopic Mass

4.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 274.12264 169.2
[M+Na]+ 296.10458 184.3
[M+NH4]+ 291.14918 175.4
[M+K]+ 312.07852 171.6
[M-H]- 272.10808 167.5
[M+Na-2H]- 294.09003 176.1
[M]+ 273.11481 170.4
[M]- 273.11591 170.4
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