CID 90203758

5-oxa-2-azaspiro[3.4]octan-7-ol hydrochloride

Structural Information

Molecular Formula
C6H11NO2
SMILES
C1C(COC12CNC2)O
InChI
InChI=1S/C6H11NO2/c8-5-1-6(9-2-5)3-7-4-6/h5,7-8H,1-4H2
InChIKey
BBXJOPXVHFPVDD-UHFFFAOYSA-N
Compound name
5-oxa-2-azaspiro[3.4]octan-7-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

16
Patents

129.07898 Da
Monoisotopic Mass

-1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 130.086256 120.3
[M+Na]+ 152.068198 125.7
[M-H]- 128.071704 122.6
[M+NH4]+ 147.112803 135.8
[M+K]+ 168.042138 128.0
[M+H-H2O]+ 112.076240 111.3
[M+HCOO]- 174.077181 137.3
[M+CH3COO]- 188.092831 166.5
[M+Na-2H]- 150.053646 127.2
[M]+ 129.07843142 124.2
[M]- 129.07952858 124.2
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