CID 138987828

Rac-[(1r,5r)-5-methyl-3-azabicyclo[3.1.0]hexan-1-yl]methanol hydrochloride

Structural Information

Molecular Formula
C7H13NO
SMILES
C[C@]12C[C@]1(CNC2)CO
InChI
InChI=1S/C7H13NO/c1-6-2-7(6,5-9)4-8-3-6/h8-9H,2-5H2,1H3/t6-,7+/m1/s1
InChIKey
HFXDZFUQSKAQNC-RQJHMYQMSA-N
Compound name
[(1S,5S)-5-methyl-3-azabicyclo[3.1.0]hexan-1-yl]methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

127.09972 Da
Monoisotopic Mass

-0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 128.106996 130.3
[M+Na]+ 150.088938 140.3
[M-H]- 126.092444 132.0
[M+NH4]+ 145.133543 151.4
[M+K]+ 166.062878 137.8
[M+H-H2O]+ 110.096980 126.8
[M+HCOO]- 172.097921 148.5
[M+CH3COO]- 186.113571 169.0
[M+Na-2H]- 148.074386 138.1
[M]+ 127.09917142 130.4
[M]- 127.10026858 130.4
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.