CID 89514432

2200258-97-3

Structural Information

Molecular Formula
C7H13NO
SMILES
C1CC12C[C@H](NC2)CO
InChI
InChI=1S/C7H13NO/c9-4-6-3-7(1-2-7)5-8-6/h6,8-9H,1-5H2/t6-/m0/s1
InChIKey
WMRHLUMWSAZZMJ-LURJTMIESA-N
Compound name
[(6S)-5-azaspiro[2.4]heptan-6-yl]methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

44
Patents

127.09972 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 128.106996 128.9
[M+Na]+ 150.088938 137.7
[M-H]- 126.092444 131.5
[M+NH4]+ 145.133543 147.4
[M+K]+ 166.062878 134.8
[M+H-H2O]+ 110.096980 124.0
[M+HCOO]- 172.097921 147.8
[M+CH3COO]- 186.113571 168.0
[M+Na-2H]- 148.074386 134.8
[M]+ 127.09917142 126.6
[M]- 127.10026858 126.6
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