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

126
Patents

113.08406 Da
Monoisotopic Mass

-0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 114.09134 123.7
[M+Na]+ 136.07328 131.4
[M-H]- 112.07678 123.9
[M+NH4]+ 131.11788 151.3
[M+K]+ 152.04722 130.1
[M+H-H2O]+ 96.081320 119.4
[M+HCOO]- 158.08226 143.5
[M+CH3COO]- 172.09791 137.5
[M+Na-2H]- 134.05873 130.0
[M]+ 113.08351 120.8
[M]- 113.08461 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