CID 28148615

Rac-(1r,2r)-2-(2-methoxyethoxy)cyclohexan-1-amine

Structural Information

Molecular Formula
C9H19NO2
SMILES
COCCO[C@@H]1CCCC[C@H]1N
InChI
InChI=1S/C9H19NO2/c1-11-6-7-12-9-5-3-2-4-8(9)10/h8-9H,2-7,10H2,1H3/t8-,9-/m1/s1
InChIKey
JOZSAZCGWGBUCD-RKDXNWHRSA-N
Compound name
(1R,2R)-2-(2-methoxyethoxy)cyclohexan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

173.14159 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 174.14887 139.7
[M+Na]+ 196.13081 143.9
[M-H]- 172.13431 141.8
[M+NH4]+ 191.17541 159.4
[M+K]+ 212.10475 143.3
[M+H-H2O]+ 156.13885 133.6
[M+HCOO]- 218.13979 160.7
[M+CH3COO]- 232.15544 181.8
[M+Na-2H]- 194.11626 143.4
[M]+ 173.14104 136.8
[M]- 173.14214 136.8
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

No patent data available for this compound.