CID 53249376

(3r)-3-methoxydecan-1-ol

Structural Information

Molecular Formula
C11H24O2
SMILES
CCCCCCC[C@H](CCO)OC
InChI
InChI=1S/C11H24O2/c1-3-4-5-6-7-8-11(13-2)9-10-12/h11-12H,3-10H2,1-2H3/t11-/m1/s1
InChIKey
FVSDHZHOJJXJTA-LLVKDONJSA-N
Compound name
(3R)-3-methoxydecan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

14
Patents

188.17763 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 189.184906 149.3
[M+Na]+ 211.166848 153.8
[M-H]- 187.170354 147.3
[M+NH4]+ 206.211453 168.5
[M+K]+ 227.140788 152.7
[M+H-H2O]+ 171.174890 144.0
[M+HCOO]- 233.175831 169.4
[M+CH3COO]- 247.191481 184.4
[M+Na-2H]- 209.152296 151.8
[M]+ 188.17708142 152.8
[M]- 188.17817858 152.8
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