CID 160268

2-benzyl-1-naphthol

Structural Information

Molecular Formula
C17H14O
SMILES
C1=CC=C(C=C1)CC2=C(C3=CC=CC=C3C=C2)O
InChI
InChI=1S/C17H14O/c18-17-15(12-13-6-2-1-3-7-13)11-10-14-8-4-5-9-16(14)17/h1-11,18H,12H2
InChIKey
CZTSOXCSVFEFIK-UHFFFAOYSA-N
Compound name
2-benzylnaphthalen-1-ol
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

9
References

661
Patents

234.10446 Da
Monoisotopic Mass

4.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 235.11174 151.7
[M+Na]+ 257.09368 159.9
[M-H]- 233.09718 158.2
[M+NH4]+ 252.13828 169.8
[M+K]+ 273.06762 154.3
[M+H-H2O]+ 217.10172 144.4
[M+HCOO]- 279.10266 173.6
[M+CH3COO]- 293.11831 164.3
[M+Na-2H]- 255.07913 159.5
[M]+ 234.10391 150.9
[M]- 234.10501 150.9
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

patents stripe