CID 84072734

2126878-55-3

Structural Information

Molecular Formula
C7H13NO
SMILES
C1C(CC12CNC2)CO
InChI
InChI=1S/C7H13NO/c9-3-6-1-7(2-6)4-8-5-7/h6,8-9H,1-5H2
InChIKey
ROXSMYHOLGAUDT-UHFFFAOYSA-N
Compound name
2-azaspiro[3.3]heptan-6-ylmethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

14
Patents

127.09972 Da
Monoisotopic Mass

-0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 128.10700 131.1
[M+Na]+ 150.08894 132.0
[M+NH4]+ 145.13354 132.7
[M+K]+ 166.06288 129.4
[M-H]- 126.09244 126.8
[M+Na-2H]- 148.07439 131.8
[M]+ 127.09917 127.8
[M]- 127.10027 127.8
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