CID 6429129

1-(2,3-dihydro-5-methyl-1h-pyrrolizin-7-yl)ethanone

Structural Information

Molecular Formula
C10H13NO
SMILES
CC1=CC(=C2N1CCC2)C(=O)C
InChI
InChI=1S/C10H13NO/c1-7-6-9(8(2)12)10-4-3-5-11(7)10/h6H,3-5H2,1-2H3
InChIKey
DJAGDEJXGVMMGJ-UHFFFAOYSA-N
Compound name
1-(3-methyl-6,7-dihydro-5H-pyrrolizin-1-yl)ethanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

163.09972 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 164.10700 136.2
[M+Na]+ 186.08894 145.3
[M-H]- 162.09244 139.9
[M+NH4]+ 181.13354 160.5
[M+K]+ 202.06288 143.4
[M+H-H2O]+ 146.09698 131.0
[M+HCOO]- 208.09792 158.5
[M+CH3COO]- 222.11357 179.4
[M+Na-2H]- 184.07439 138.4
[M]+ 163.09917 136.7
[M]- 163.10027 136.7
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

No patent data available for this compound.