CID 167718699

{6-methyl-1-azaspiro[3.3]heptan-6-yl}methanol, mixture of diastereomers

Structural Information

Molecular Formula
C8H15NO
SMILES
CC1(CC2(C1)CCN2)CO
InChI
InChI=1S/C8H15NO/c1-7(6-10)4-8(5-7)2-3-9-8/h9-10H,2-6H2,1H3
InChIKey
XLFYJCHLCZTNKZ-UHFFFAOYSA-N
Compound name
(6-methyl-1-azaspiro[3.3]heptan-6-yl)methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

141.11537 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 142.12265 129.8
[M+Na]+ 164.10459 134.5
[M-H]- 140.10809 131.9
[M+NH4]+ 159.14919 139.5
[M+K]+ 180.07853 137.6
[M+H-H2O]+ 124.11263 118.2
[M+HCOO]- 186.11357 144.8
[M+CH3COO]- 200.12922 182.4
[M+Na-2H]- 162.09004 136.4
[M]+ 141.11482 142.4
[M]- 141.11592 142.4
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.