CID 155937654

2243515-58-2

Structural Information

Molecular Formula
C8H15NO2
SMILES
C1CC2(C1)COCC(O2)CN
InChI
InChI=1S/C8H15NO2/c9-4-7-5-10-6-8(11-7)2-1-3-8/h7H,1-6,9H2
InChIKey
VOUFPXXKTUTDQD-UHFFFAOYSA-N
Compound name
5,8-dioxaspiro[3.5]nonan-6-ylmethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

157.11028 Da
Monoisotopic Mass

-0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 158.11756 127.3
[M+Na]+ 180.09950 131.0
[M-H]- 156.10300 133.1
[M+NH4]+ 175.14410 140.6
[M+K]+ 196.07344 135.7
[M+H-H2O]+ 140.10754 117.2
[M+HCOO]- 202.10848 145.1
[M+CH3COO]- 216.12413 179.3
[M+Na-2H]- 178.08495 135.8
[M]+ 157.10973 131.8
[M]- 157.11083 131.8
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

No patent data available for this compound.