CID 10011869

1-azabicyclo[2.2.1]heptan-4-ol hydrochloride

Structural Information

Molecular Formula
C6H11NO
SMILES
C1CN2CCC1(C2)O
InChI
InChI=1S/C6H11NO/c8-6-1-3-7(5-6)4-2-6/h8H,1-5H2
InChIKey
DSNGLKATJGBVIX-UHFFFAOYSA-N
Compound name
1-azabicyclo[2.2.1]heptan-4-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

158
Patents

113.08406 Da
Monoisotopic Mass

-0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 114.091336 123.7
[M+Na]+ 136.073278 131.4
[M-H]- 112.076784 123.9
[M+NH4]+ 131.117883 151.3
[M+K]+ 152.047218 130.1
[M+H-H2O]+ 96.081320 119.4
[M+HCOO]- 158.082261 143.5
[M+CH3COO]- 172.097911 137.5
[M+Na-2H]- 134.058726 130.0
[M]+ 113.08351142 120.8
[M]- 113.08460858 120.8
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