CID 21955265

2-oxa-8-azaspiro[4.5]decane hydrochloride

Structural Information

Molecular Formula
C8H15NO
SMILES
C1CNCCC12CCOC2
InChI
InChI=1S/C8H15NO/c1-4-9-5-2-8(1)3-6-10-7-8/h9H,1-7H2
InChIKey
OXXXNXISRXFPBK-UHFFFAOYSA-N
Compound name
2-oxa-8-azaspiro[4.5]decane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

845
Patents

141.11537 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 142.122646 131.3
[M+Na]+ 164.104588 135.5
[M-H]- 140.108094 133.6
[M+NH4]+ 159.149193 152.9
[M+K]+ 180.078528 134.9
[M+H-H2O]+ 124.112630 125.2
[M+HCOO]- 186.113571 147.6
[M+CH3COO]- 200.129221 143.2
[M+Na-2H]- 162.090036 137.4
[M]+ 141.11482142 123.1
[M]- 141.11591858 123.1
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