CID 148284510

2731014-40-5

Structural Information

Molecular Formula
C8H15N
SMILES
CCC1CNC12CCC2
InChI
InChI=1S/C8H15N/c1-2-7-6-9-8(7)4-3-5-8/h7,9H,2-6H2,1H3
InChIKey
KWAWVXMEALEDHP-UHFFFAOYSA-N
Compound name
3-ethyl-1-azaspiro[3.3]heptane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

125.12045 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 126.127726 121.7
[M+Na]+ 148.109668 126.3
[M-H]- 124.113174 124.7
[M+NH4]+ 143.154273 131.0
[M+K]+ 164.083608 129.9
[M+H-H2O]+ 108.117710 108.9
[M+HCOO]- 170.118651 138.1
[M+CH3COO]- 184.134301 183.2
[M+Na-2H]- 146.095116 128.4
[M]+ 125.11990142 134.5
[M]- 125.12099858 134.5
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

No patent data available for this compound.