CID 54178390

207405-59-2

Structural Information

Molecular Formula
C11H19NO3
SMILES
CC(C)(C)OC(=O)N1CC2CC1C(C2)O
InChI
InChI=1S/C11H19NO3/c1-11(2,3)15-10(14)12-6-7-4-8(12)9(13)5-7/h7-9,13H,4-6H2,1-3H3
InChIKey
PABFVGKPNHVSCG-UHFFFAOYSA-N
Compound name
tert-butyl 6-hydroxy-2-azabicyclo[2.2.1]heptane-2-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

86
Patents

213.13649 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 214.14377 152.5
[M+Na]+ 236.12571 159.3
[M-H]- 212.12921 152.8
[M+NH4]+ 231.17031 174.8
[M+K]+ 252.09965 158.2
[M+H-H2O]+ 196.13375 148.6
[M+HCOO]- 258.13469 168.5
[M+CH3COO]- 272.15034 184.3
[M+Na-2H]- 234.11116 154.0
[M]+ 213.13594 152.7
[M]- 213.13704 152.7
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