CID 18770857

4-methyl-4,7-diazaspiro[2.5]octane dihydrochloride

Structural Information

Molecular Formula
C7H14N2
SMILES
CN1CCNCC12CC2
InChI
InChI=1S/C7H14N2/c1-9-5-4-8-6-7(9)2-3-7/h8H,2-6H2,1H3
InChIKey
LLRVPJUCDHSVJZ-UHFFFAOYSA-N
Compound name
4-methyl-4,7-diazaspiro[2.5]octane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

119
Patents

126.1157 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 127.12298 135.6
[M+Na]+ 149.10492 143.9
[M-H]- 125.10842 137.8
[M+NH4]+ 144.14952 151.7
[M+K]+ 165.07886 141.7
[M+H-H2O]+ 109.11296 128.9
[M+HCOO]- 171.11390 152.6
[M+CH3COO]- 185.12955 147.3
[M+Na-2H]- 147.09037 142.6
[M]+ 126.11515 131.9
[M]- 126.11625 131.9
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