CID 68035107

2-ethyl-2,6-diazaspiro[3.3]heptane dihydrochloride

Structural Information

Molecular Formula
C7H14N2
SMILES
CCN1CC2(C1)CNC2
InChI
InChI=1S/C7H14N2/c1-2-9-5-7(6-9)3-8-4-7/h8H,2-6H2,1H3
InChIKey
FEQYGZQTXXNFHS-UHFFFAOYSA-N
Compound name
2-ethyl-2,6-diazaspiro[3.3]heptane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

10
Patents

126.1157 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 127.12298 122.7
[M+Na]+ 149.10492 127.7
[M-H]- 125.10842 124.3
[M+NH4]+ 144.14952 130.7
[M+K]+ 165.07886 131.5
[M+H-H2O]+ 109.11296 108.9
[M+HCOO]- 171.11390 138.2
[M+CH3COO]- 185.12955 182.9
[M+Na-2H]- 147.09037 129.6
[M]+ 126.11515 135.6
[M]- 126.11625 135.6
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