CID 22273107

8-oxabicyclo[3.2.1]octan-3-amine

Structural Information

Molecular Formula
C7H13NO
SMILES
C1CC2CC(CC1O2)N
InChI
InChI=1S/C7H13NO/c8-5-3-6-1-2-7(4-5)9-6/h5-7H,1-4,8H2
InChIKey
LTDXJGJQKVIVHB-UHFFFAOYSA-N
Compound name
8-oxabicyclo[3.2.1]octan-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

85
Patents

127.09972 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 128.10700 124.6
[M+Na]+ 150.08894 133.9
[M+NH4]+ 145.13354 134.7
[M+K]+ 166.06288 130.3
[M-H]- 126.09244 127.6
[M+Na-2H]- 148.07439 126.9
[M]+ 127.09917 126.5
[M]- 127.10027 126.5
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