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]+ 142.12265 124.6
[M+Na]+ 164.10459 126.7
[M-H]- 140.10809 128.2
[M+NH4]+ 159.14919 137.1
[M+K]+ 180.07853 131.1
[M+H-H2O]+ 124.11263 115.3
[M+HCOO]- 186.11357 139.6
[M+CH3COO]- 200.12922 174.6
[M+Na-2H]- 162.09004 132.2
[M]+ 141.11482 123.8
[M]- 141.11592 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