CID 97475

33230-77-2

Structural Information

Molecular Formula
C22H18O2
SMILES
COC1=C(C2=CC=CC=C2C=C1)CC3=C(C=CC4=CC=CC=C43)O
InChI
InChI=1S/C22H18O2/c1-24-22-13-11-16-7-3-5-9-18(16)20(22)14-19-17-8-4-2-6-15(17)10-12-21(19)23/h2-13,23H,14H2,1H3
InChIKey
ULSKQMQZZCFDEQ-UHFFFAOYSA-N
Compound name
1-[(2-methoxynaphthalen-1-yl)methyl]naphthalen-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

7
Patents

314.13068 Da
Monoisotopic Mass

6.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 315.13796 174.0
[M+Na]+ 337.11990 183.7
[M-H]- 313.12340 181.7
[M+NH4]+ 332.16450 189.9
[M+K]+ 353.09384 177.1
[M+H-H2O]+ 297.12794 165.1
[M+HCOO]- 359.12888 195.1
[M+CH3COO]- 373.14453 185.7
[M+Na-2H]- 335.10535 181.3
[M]+ 314.13013 176.8
[M]- 314.13123 176.8
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