CID 44827707

1-oxaspiro[4.4]nonan-3-amine hydrochloride

Structural Information

Molecular Formula
C8H15NO
SMILES
C1CCC2(C1)CC(CO2)N
InChI
InChI=1S/C8H15NO/c9-7-5-8(10-6-7)3-1-2-4-8/h7H,1-6,9H2
InChIKey
LTYSMVXAJZQBNP-UHFFFAOYSA-N
Compound name
1-oxaspiro[4.4]nonan-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

32
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 130.5
[M+Na]+ 164.104588 136.1
[M-H]- 140.108094 135.8
[M+NH4]+ 159.149193 155.6
[M+K]+ 180.078528 135.8
[M+H-H2O]+ 124.112630 125.9
[M+HCOO]- 186.113571 152.1
[M+CH3COO]- 200.129221 171.8
[M+Na-2H]- 162.090036 134.9
[M]+ 141.11482142 124.5
[M]- 141.11591858 124.5
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