CID 91647688

Rac-(1r,2r)-2-ethoxycyclopentan-1-ol

Structural Information

Molecular Formula
C7H14O2
SMILES
CCO[C@@H]1CCC[C@H]1O
InChI
InChI=1S/C7H14O2/c1-2-9-7-5-3-4-6(7)8/h6-8H,2-5H2,1H3/t6-,7-/m1/s1
InChIKey
CLFRTEKMZDRKMW-RNFRBKRXSA-N
Compound name
trans-(1R,2R)-2-ethoxycyclopentan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

130.09938 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 131.106656 127.8
[M+Na]+ 153.088598 134.3
[M-H]- 129.092104 129.7
[M+NH4]+ 148.133203 151.0
[M+K]+ 169.062538 133.7
[M+H-H2O]+ 113.096640 123.2
[M+HCOO]- 175.097581 149.7
[M+CH3COO]- 189.113231 168.6
[M+Na-2H]- 151.074046 131.6
[M]+ 130.09883142 126.1
[M]- 130.09992858 126.1
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