CID 23111899

2-oxa-7-azaspiro[4.4]nonane

Structural Information

Molecular Formula
C7H13NO
SMILES
C1CNCC12CCOC2
InChI
InChI=1S/C7H13NO/c1-3-8-5-7(1)2-4-9-6-7/h8H,1-6H2
InChIKey
UGQAXUDFJWQPHM-UHFFFAOYSA-N
Compound name
2-oxa-7-azaspiro[4.4]nonane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

642
Patents

127.09972 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 128.106996 127.4
[M+Na]+ 150.088938 133.0
[M-H]- 126.092444 130.3
[M+NH4]+ 145.133543 151.3
[M+K]+ 166.062878 132.7
[M+H-H2O]+ 110.096980 122.1
[M+HCOO]- 172.097921 146.3
[M+CH3COO]- 186.113571 140.4
[M+Na-2H]- 148.074386 132.6
[M]+ 127.09917142 121.1
[M]- 127.10026858 121.1
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