CID 66212345

2-cyclobutyl-octahydropyrrolo[3,4-c]pyrrole

Structural Information

Molecular Formula
C10H18N2
SMILES
C1CC(C1)N2CC3CNCC3C2
InChI
InChI=1S/C10H18N2/c1-2-10(3-1)12-6-8-4-11-5-9(8)7-12/h8-11H,1-7H2
InChIKey
DGDAYAAJFLRPGL-UHFFFAOYSA-N
Compound name
5-cyclobutyl-2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[3,4-c]pyrrole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

6
Patents

166.147 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 167.15428 134.1
[M+Na]+ 189.13622 138.1
[M-H]- 165.13972 136.9
[M+NH4]+ 184.18082 149.2
[M+K]+ 205.11016 138.3
[M+H-H2O]+ 149.14426 122.8
[M+HCOO]- 211.14520 149.8
[M+CH3COO]- 225.16085 145.3
[M+Na-2H]- 187.12167 135.2
[M]+ 166.14645 136.0
[M]- 166.14755 136.0
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