CID 10130270

2-(naphthalen-2-yl)propan-1-ol

Structural Information

Molecular Formula
C13H14O
SMILES
CC(CO)C1=CC2=CC=CC=C2C=C1
InChI
InChI=1S/C13H14O/c1-10(9-14)12-7-6-11-4-2-3-5-13(11)8-12/h2-8,10,14H,9H2,1H3
InChIKey
ZWXFVNCTKLTZEZ-UHFFFAOYSA-N
Compound name
2-naphthalen-2-ylpropan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

41
Patents

186.10446 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 187.111736 140.0
[M+Na]+ 209.093678 147.4
[M-H]- 185.097184 143.2
[M+NH4]+ 204.138283 160.3
[M+K]+ 225.067618 143.8
[M+H-H2O]+ 169.101720 134.2
[M+HCOO]- 231.102661 160.9
[M+CH3COO]- 245.118311 182.2
[M+Na-2H]- 207.079126 147.0
[M]+ 186.10391142 139.4
[M]- 186.10500858 139.4
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