CID 72942839

6-azaspiro[2.5]octan-1-ylmethanol

Structural Information

Molecular Formula
C8H15NO
SMILES
C1CNCCC12CC2CO
InChI
InChI=1S/C8H15NO/c10-6-7-5-8(7)1-3-9-4-2-8/h7,9-10H,1-6H2
InChIKey
BAOOOTDYBKVUPX-UHFFFAOYSA-N
Compound name
6-azaspiro[2.5]octan-2-ylmethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

20
Patents

141.11537 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 142.12265 134.6
[M+Na]+ 164.10459 142.0
[M-H]- 140.10809 136.7
[M+NH4]+ 159.14919 150.8
[M+K]+ 180.07853 139.3
[M+H-H2O]+ 124.11263 129.0
[M+HCOO]- 186.11357 151.2
[M+CH3COO]- 200.12922 171.1
[M+Na-2H]- 162.09004 141.1
[M]+ 141.11482 130.6
[M]- 141.11592 130.6
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