CID 117771421

1-azaspiro[3.3]heptan-6-ol

Structural Information

Molecular Formula
C6H11NO
SMILES
C1CNC12CC(C2)O
InChI
InChI=1S/C6H11NO/c8-5-3-6(4-5)1-2-7-6/h5,7-8H,1-4H2
InChIKey
QQIZPINZVQELRS-UHFFFAOYSA-N
Compound name
1-azaspiro[3.3]heptan-6-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

12
Patents

113.08406 Da
Monoisotopic Mass

-0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 114.09134 127.0
[M+Na]+ 136.07328 128.1
[M+NH4]+ 131.11788 128.8
[M+K]+ 152.04722 125.7
[M-H]- 112.07678 122.7
[M+Na-2H]- 134.05873 128.0
[M]+ 113.08351 123.7
[M]- 113.08461 123.7
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