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

42
Patents

186.10446 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 187.11174 140.0
[M+Na]+ 209.09368 147.4
[M-H]- 185.09718 143.2
[M+NH4]+ 204.13828 160.3
[M+K]+ 225.06762 143.8
[M+H-H2O]+ 169.10172 134.2
[M+HCOO]- 231.10266 160.9
[M+CH3COO]- 245.11831 182.2
[M+Na-2H]- 207.07913 147.0
[M]+ 186.10391 139.4
[M]- 186.10501 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