CID 10997117

7-methyl-2,7-diazaspiro[3.5]nonane dihydrochloride

Structural Information

Molecular Formula
C8H16N2
SMILES
CN1CCC2(CC1)CNC2
InChI
InChI=1S/C8H16N2/c1-10-4-2-8(3-5-10)6-9-7-8/h9H,2-7H2,1H3
InChIKey
QOIARYNCRPZCTG-UHFFFAOYSA-N
Compound name
7-methyl-2,7-diazaspiro[3.5]nonane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

303
Patents

140.13135 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 141.13863 131.7
[M+Na]+ 163.12057 137.9
[M+NH4]+ 158.16517 138.0
[M+K]+ 179.09451 132.0
[M-H]- 139.12407 130.6
[M+Na-2H]- 161.10602 135.8
[M]+ 140.13080 131.0
[M]- 140.13190 131.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

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