CID 83856338

1781039-95-9

Structural Information

Molecular Formula
C6H11NO
SMILES
C1CNC2(C1O)CC2
InChI
InChI=1S/C6H11NO/c8-5-1-4-7-6(5)2-3-6/h5,7-8H,1-4H2
InChIKey
LMDVLNHRTIBTGT-UHFFFAOYSA-N
Compound name
4-azaspiro[2.4]heptan-7-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
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 124.8
[M+Na]+ 136.07328 134.0
[M-H]- 112.07678 127.6
[M+NH4]+ 131.11788 143.9
[M+K]+ 152.04722 131.3
[M+H-H2O]+ 96.081320 120.0
[M+HCOO]- 158.08226 144.0
[M+CH3COO]- 172.09791 165.1
[M+Na-2H]- 134.05873 131.2
[M]+ 113.08351 122.1
[M]- 113.08461 122.1
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.