CID 142164375

Rel-1-((1r,2r)-2-methylcyclopentyl)ethanol

Structural Information

Molecular Formula
C8H16O
SMILES
C[C@@H]1CCC[C@H]1C(C)O
InChI
InChI=1S/C8H16O/c1-6-4-3-5-8(6)7(2)9/h6-9H,3-5H2,1-2H3/t6-,7?,8-/m1/s1
InChIKey
PWNGUKSWPILNCX-OECOWPMFSA-N
Compound name
1-[(1R,2R)-2-methylcyclopentyl]ethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

128.12012 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 129.12740 129.1
[M+Na]+ 151.10934 138.4
[M+NH4]+ 146.15394 138.0
[M+K]+ 167.08328 135.0
[M-H]- 127.11284 130.1
[M+Na-2H]- 149.09479 132.7
[M]+ 128.11957 130.4
[M]- 128.12067 130.4
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

No patent data available for this compound.