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

51
Patents

127.09972 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 128.10700 128.9
[M+Na]+ 150.08894 137.7
[M-H]- 126.09244 131.5
[M+NH4]+ 145.13354 147.4
[M+K]+ 166.06288 134.8
[M+H-H2O]+ 110.09698 124.0
[M+HCOO]- 172.09792 147.8
[M+CH3COO]- 186.11357 168.0
[M+Na-2H]- 148.07439 134.8
[M]+ 127.09917 126.6
[M]- 127.10027 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