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]+ 128.10700 130.3
[M+Na]+ 150.08894 140.3
[M-H]- 126.09244 132.0
[M+NH4]+ 145.13354 151.4
[M+K]+ 166.06288 137.8
[M+H-H2O]+ 110.09698 126.8
[M+HCOO]- 172.09792 148.5
[M+CH3COO]- 186.11357 169.0
[M+Na-2H]- 148.07439 138.1
[M]+ 127.09917 130.4
[M]- 127.10027 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.