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

11
Patents

126.1157 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 127.122976 122.7
[M+Na]+ 149.104918 127.7
[M-H]- 125.108424 124.3
[M+NH4]+ 144.149523 130.7
[M+K]+ 165.078858 131.5
[M+H-H2O]+ 109.112960 108.9
[M+HCOO]- 171.113901 138.2
[M+CH3COO]- 185.129551 182.9
[M+Na-2H]- 147.090366 129.6
[M]+ 126.11515142 135.6
[M]- 126.11624858 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