CID 132261185

2170372-24-2

Structural Information

Molecular Formula
C6H11NO
SMILES
CC12CC(C1)(CO2)N
InChI
InChI=1S/C6H11NO/c1-5-2-6(7,3-5)4-8-5/h2-4,7H2,1H3
InChIKey
AHVAATWZOGWTOX-UHFFFAOYSA-N
Compound name
1-methyl-2-oxabicyclo[2.1.1]hexan-4-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

56
Patents

113.08406 Da
Monoisotopic Mass

-0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 114.09134 126.4
[M+Na]+ 136.07328 133.7
[M-H]- 112.07678 128.5
[M+NH4]+ 131.11788 151.7
[M+K]+ 152.04722 135.8
[M+H-H2O]+ 96.081320 120.9
[M+HCOO]- 158.08226 145.3
[M+CH3COO]- 172.09791 140.4
[M+Na-2H]- 134.05873 137.0
[M]+ 113.08351 138.1
[M]- 113.08461 138.1
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