CID 138039819

2241127-88-6

Structural Information

Molecular Formula
C10H17NO2
SMILES
CC12CC(C1)(C3(O2)CCOCC3)N
InChI
InChI=1S/C10H17NO2/c1-8-6-9(11,7-8)10(13-8)2-4-12-5-3-10/h2-7,11H2,1H3
InChIKey
PESPDKAUUZKSQW-UHFFFAOYSA-N
Compound name
1-methylspiro[2-oxabicyclo[2.1.1]hexane-3,4'-oxane]-4-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

183.12593 Da
Monoisotopic Mass

-0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 184.133206 138.9
[M+Na]+ 206.115148 144.4
[M-H]- 182.118654 143.4
[M+NH4]+ 201.159753 161.8
[M+K]+ 222.089088 146.6
[M+H-H2O]+ 166.123190 132.6
[M+HCOO]- 228.124131 153.3
[M+CH3COO]- 242.139781 151.4
[M+Na-2H]- 204.100596 148.6
[M]+ 183.12538142 148.6
[M]- 183.12647858 148.6
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.