CID 62669694

1-(2-phenoxyethyl)cyclopropan-1-ol

Structural Information

Molecular Formula
C11H14O2
SMILES
C1CC1(CCOC2=CC=CC=C2)O
InChI
InChI=1S/C11H14O2/c12-11(6-7-11)8-9-13-10-4-2-1-3-5-10/h1-5,12H,6-9H2
InChIKey
AKVYVGIXRROCNZ-UHFFFAOYSA-N
Compound name
1-(2-phenoxyethyl)cyclopropan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

178.09938 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 179.10666 137.7
[M+Na]+ 201.08860 146.5
[M-H]- 177.09210 144.1
[M+NH4]+ 196.13320 154.1
[M+K]+ 217.06254 144.4
[M+H-H2O]+ 161.09664 132.1
[M+HCOO]- 223.09758 160.8
[M+CH3COO]- 237.11323 180.3
[M+Na-2H]- 199.07405 145.9
[M]+ 178.09883 140.9
[M]- 178.09993 140.9
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