CID 155822525

2503155-70-0

Structural Information

Molecular Formula
C11H20N2O3
SMILES
CC(C)(C)OC(=O)N[C@@H]1C[C@@]2(C[C@H]1OC2)N
InChI
InChI=1S/C11H20N2O3/c1-10(2,3)16-9(14)13-7-4-11(12)5-8(7)15-6-11/h7-8H,4-6,12H2,1-3H3,(H,13,14)/t7-,8-,11+/m1/s1
InChIKey
XVOVALLGIHNFEA-XLDPMVHQSA-N
Compound name
tert-butyl N-[(1R,4S,6R)-4-amino-2-oxabicyclo[2.2.1]heptan-6-yl]carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

228.1474 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 229.15468 150.8
[M+Na]+ 251.13662 155.2
[M+NH4]+ 246.18122 159.0
[M+K]+ 267.11056 154.8
[M-H]- 227.14012 150.8
[M+Na-2H]- 249.12207 151.2
[M]+ 228.14685 151.0
[M]- 228.14795 151.0
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.