CID 170916328

2-[(1r,5s,6r)-3-azabicyclo[3.1.0]hexan-6-yl]propan-2-ol

Structural Information

Molecular Formula
C8H15NO
SMILES
CC(C)(C1[C@H]2[C@@H]1CNC2)O
InChI
InChI=1S/C8H15NO/c1-8(2,10)7-5-3-9-4-6(5)7/h5-7,9-10H,3-4H2,1-2H3/t5-,6+,7?
InChIKey
MGYYNDGUQYDYDS-MEKDEQNOSA-N
Compound name
2-[(1S,5R)-3-azabicyclo[3.1.0]hexan-6-yl]propan-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

141.11537 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 142.122646 133.2
[M+Na]+ 164.104588 142.5
[M-H]- 140.108094 134.5
[M+NH4]+ 159.149193 150.4
[M+K]+ 180.078528 138.5
[M+H-H2O]+ 124.112630 128.4
[M+HCOO]- 186.113571 150.1
[M+CH3COO]- 200.129221 173.8
[M+Na-2H]- 162.090036 138.6
[M]+ 141.11482142 132.6
[M]- 141.11591858 132.6
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

No patent data available for this compound.