CID 86127326

2,3-dihydro-5,6-dimethyl-1h-pyrrolizine-7-carboxaldehyde

Structural Information

Molecular Formula
C10H13NO
SMILES
CC1=C(N2CCCC2=C1C=O)C
InChI
InChI=1S/C10H13NO/c1-7-8(2)11-5-3-4-10(11)9(7)6-12/h6H,3-5H2,1-2H3
InChIKey
MBJGXSSIUJRGNO-UHFFFAOYSA-N
Compound name
2,3-dimethyl-6,7-dihydro-5H-pyrrolizine-1-carbaldehyde
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

163.09972 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 164.106996 135.0
[M+Na]+ 186.088938 145.3
[M-H]- 162.092444 139.0
[M+NH4]+ 181.133543 159.8
[M+K]+ 202.062878 142.9
[M+H-H2O]+ 146.096980 130.1
[M+HCOO]- 208.097921 158.3
[M+CH3COO]- 222.113571 179.7
[M+Na-2H]- 184.074386 137.8
[M]+ 163.09917142 136.6
[M]- 163.10026858 136.6
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.