CID 10920488

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

Structural Information

Molecular Formula
C6H12O2
SMILES
CO[C@@H]1CCC[C@H]1O
InChI
InChI=1S/C6H12O2/c1-8-6-4-2-3-5(6)7/h5-7H,2-4H2,1H3/t5-,6-/m1/s1
InChIKey
YVXLDOASGKIXII-PHDIDXHHSA-N
Compound name
(1R,2R)-2-methoxycyclopentan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

51
Patents

116.08373 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 117.09101 123.1
[M+Na]+ 139.07295 130.1
[M-H]- 115.07645 125.3
[M+NH4]+ 134.11755 146.9
[M+K]+ 155.04689 129.7
[M+H-H2O]+ 99.080990 118.7
[M+HCOO]- 161.08193 145.4
[M+CH3COO]- 175.09758 165.6
[M+Na-2H]- 137.05840 127.5
[M]+ 116.08318 121.1
[M]- 116.08428 121.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe