CID 57856653

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

Structural Information

Molecular Formula
C6H12N2
SMILES
CN1CC2(C1)CNC2
InChI
InChI=1S/C6H12N2/c1-8-4-6(5-8)2-7-3-6/h7H,2-5H2,1H3
InChIKey
ALPTZPFVGLVIKK-UHFFFAOYSA-N
Compound name
2-methyl-2,6-diazaspiro[3.3]heptane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

557
Patents

112.10005 Da
Monoisotopic Mass

-0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 113.10733 118.4
[M+Na]+ 135.08927 123.7
[M-H]- 111.09277 120.2
[M+NH4]+ 130.13387 126.9
[M+K]+ 151.06321 127.8
[M+H-H2O]+ 95.097310 104.8
[M+HCOO]- 157.09825 134.2
[M+CH3COO]- 171.11390 180.3
[M+Na-2H]- 133.07472 125.8
[M]+ 112.09950 131.0
[M]- 112.10060 131.0
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