CID 83479113

2-oxaspiro[3.5]nonan-7-amine

Structural Information

Molecular Formula
C8H15NO
SMILES
C1CC2(CCC1N)COC2
InChI
InChI=1S/C8H15NO/c9-7-1-3-8(4-2-7)5-10-6-8/h7H,1-6,9H2
InChIKey
ARQNRYRGUMKTJV-UHFFFAOYSA-N
Compound name
2-oxaspiro[3.5]nonan-7-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

35
Patents

141.11537 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 142.122646 125.6
[M+Na]+ 164.104588 129.5
[M-H]- 140.108094 130.9
[M+NH4]+ 159.149193 141.0
[M+K]+ 180.078528 132.7
[M+H-H2O]+ 124.112630 115.7
[M+HCOO]- 186.113571 144.2
[M+CH3COO]- 200.129221 177.1
[M+Na-2H]- 162.090036 133.1
[M]+ 141.11482142 128.2
[M]- 141.11591858 128.2
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