CID 154575242

{5-azaspiro[2.5]octan-6-yl}methanol

Structural Information

Molecular Formula
C8H15NO
SMILES
C1CC2(CC2)CNC1CO
InChI
InChI=1S/C8H15NO/c10-5-7-1-2-8(3-4-8)6-9-7/h7,9-10H,1-6H2
InChIKey
JRWJSHGUYJGMRQ-UHFFFAOYSA-N
Compound name
5-azaspiro[2.5]octan-6-ylmethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

141.11537 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 142.122646 134.6
[M+Na]+ 164.104588 142.0
[M-H]- 140.108094 136.7
[M+NH4]+ 159.149193 150.8
[M+K]+ 180.078528 139.3
[M+H-H2O]+ 124.112630 129.0
[M+HCOO]- 186.113571 151.2
[M+CH3COO]- 200.129221 171.1
[M+Na-2H]- 162.090036 141.1
[M]+ 141.11482142 130.6
[M]- 141.11591858 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