CID 21955367

2-oxa-9-azaspiro[5.5]undecane hydrochloride

Structural Information

Molecular Formula
C9H17NO
SMILES
C1CC2(CCNCC2)COC1
InChI
InChI=1S/C9H17NO/c1-2-9(8-11-7-1)3-5-10-6-4-9/h10H,1-8H2
InChIKey
WTRQSWYPRFTEFE-UHFFFAOYSA-N
Compound name
2-oxa-9-azaspiro[5.5]undecane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

55
Patents

155.13101 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 156.138286 135.7
[M+Na]+ 178.120228 138.5
[M-H]- 154.123734 137.6
[M+NH4]+ 173.164833 154.8
[M+K]+ 194.094168 137.8
[M+H-H2O]+ 138.128270 128.9
[M+HCOO]- 200.129211 149.5
[M+CH3COO]- 214.144861 146.4
[M+Na-2H]- 176.105676 142.9
[M]+ 155.13046142 125.7
[M]- 155.13155858 125.7
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