CID 55279769

6-oxa-2-azaspiro[3.4]octane hydrochloride

Structural Information

Molecular Formula
C6H11NO
SMILES
C1COCC12CNC2
InChI
InChI=1S/C6H11NO/c1-2-8-5-6(1)3-7-4-6/h7H,1-5H2
InChIKey
BDHMQGDCUCSDHX-UHFFFAOYSA-N
Compound name
6-oxa-2-azaspiro[3.4]octane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1384
Patents

113.08406 Da
Monoisotopic Mass

-0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 114.09134 116.1
[M+Na]+ 136.07328 121.3
[M-H]- 112.07678 119.4
[M+NH4]+ 131.11788 132.7
[M+K]+ 152.04722 124.0
[M+H-H2O]+ 96.081320 106.9
[M+HCOO]- 158.08226 134.5
[M+CH3COO]- 172.09791 166.0
[M+Na-2H]- 134.05873 124.2
[M]+ 113.08351 120.1
[M]- 113.08461 120.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe