CID 61749157

2-[(2-methoxyphenyl)methyl]cyclopentan-1-ol

Structural Information

Molecular Formula
C13H18O2
SMILES
COC1=CC=CC=C1CC2CCCC2O
InChI
InChI=1S/C13H18O2/c1-15-13-8-3-2-5-11(13)9-10-6-4-7-12(10)14/h2-3,5,8,10,12,14H,4,6-7,9H2,1H3
InChIKey
BEZPHADQLNSEQG-UHFFFAOYSA-N
Compound name
2-[(2-methoxyphenyl)methyl]cyclopentan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

206.13068 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 207.13796 146.7
[M+Na]+ 229.11990 153.0
[M-H]- 205.12340 151.9
[M+NH4]+ 224.16450 166.9
[M+K]+ 245.09384 150.1
[M+H-H2O]+ 189.12794 140.7
[M+HCOO]- 251.12888 168.3
[M+CH3COO]- 265.14453 183.3
[M+Na-2H]- 227.10535 149.1
[M]+ 206.13013 145.2
[M]- 206.13123 145.2
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

No patent data available for this compound.