CID 137935714

2253629-55-7

Structural Information

Molecular Formula
C10H17NO3
SMILES
C1COCCC12C3(CC(C3)(O2)CO)N
InChI
InChI=1S/C10H17NO3/c11-9-5-8(6-9,7-12)14-10(9)1-3-13-4-2-10/h12H,1-7,11H2
InChIKey
MWOLQRWYDUJRBE-UHFFFAOYSA-N
Compound name
(4-aminospiro[2-oxabicyclo[2.1.1]hexane-3,4'-oxane]-1-yl)methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

199.12085 Da
Monoisotopic Mass

-1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 200.128126 142.6
[M+Na]+ 222.110068 147.4
[M-H]- 198.113574 145.7
[M+NH4]+ 217.154673 164.1
[M+K]+ 238.084008 149.5
[M+H-H2O]+ 182.118110 136.5
[M+HCOO]- 244.119051 155.6
[M+CH3COO]- 258.134701 154.2
[M+Na-2H]- 220.095516 152.2
[M]+ 199.12030142 152.1
[M]- 199.12139858 152.1
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

No patent data available for this compound.