CID 86127323

Bjtrwjsvqkomjy-uhfffaoysa-n

Structural Information

Molecular Formula
C11H15NO
SMILES
CC1=C(N2CCCC2=C1C(=O)C)C
InChI
InChI=1S/C11H15NO/c1-7-8(2)12-6-4-5-10(12)11(7)9(3)13/h4-6H2,1-3H3
InChIKey
BJTRWJSVQKOMJY-UHFFFAOYSA-N
Compound name
1-(2,3-dimethyl-6,7-dihydro-5H-pyrrolizin-1-yl)ethanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

177.11537 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 178.122646 140.2
[M+Na]+ 200.104588 149.7
[M-H]- 176.108094 144.1
[M+NH4]+ 195.149193 164.3
[M+K]+ 216.078528 147.6
[M+H-H2O]+ 160.112630 135.2
[M+HCOO]- 222.113571 162.1
[M+CH3COO]- 236.129221 183.6
[M+Na-2H]- 198.090036 141.2
[M]+ 177.11482142 141.4
[M]- 177.11591858 141.4
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.