CID 49548

67196-21-8

Structural Information

Molecular Formula
C9H16N2O2
SMILES
CN1CC2CCC(C1)N2C(=O)OC
InChI
InChI=1S/C9H16N2O2/c1-10-5-7-3-4-8(6-10)11(7)9(12)13-2/h7-8H,3-6H2,1-2H3
InChIKey
FEZVKEOPBBKYEP-UHFFFAOYSA-N
Compound name
methyl 3-methyl-3,8-diazabicyclo[3.2.1]octane-8-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

28
Patents

184.12119 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 185.128466 142.1
[M+Na]+ 207.110408 149.0
[M-H]- 183.113914 141.9
[M+NH4]+ 202.155013 162.9
[M+K]+ 223.084348 148.0
[M+H-H2O]+ 167.118450 135.7
[M+HCOO]- 229.119391 158.2
[M+CH3COO]- 243.135041 181.8
[M+Na-2H]- 205.095856 145.1
[M]+ 184.12064142 140.9
[M]- 184.12173858 140.9
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