CID 118210701

2230803-85-5

Structural Information

Molecular Formula
C8H15NO
SMILES
C1CC2(CCNC1)CCO2
InChI
InChI=1S/C8H15NO/c1-2-8(4-7-10-8)3-6-9-5-1/h9H,1-7H2
InChIKey
NJJQDVAEWWUQFS-UHFFFAOYSA-N
Compound name
1-oxa-8-azaspiro[3.6]decane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

141.11537 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 142.122646 124.6
[M+Na]+ 164.104588 126.7
[M-H]- 140.108094 128.2
[M+NH4]+ 159.149193 137.1
[M+K]+ 180.078528 131.1
[M+H-H2O]+ 124.112630 115.3
[M+HCOO]- 186.113571 139.6
[M+CH3COO]- 200.129221 174.6
[M+Na-2H]- 162.090036 132.2
[M]+ 141.11482142 123.8
[M]- 141.11591858 123.8
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