CID 3063552

8-diacetamidolilolidine

Structural Information

Molecular Formula
C15H18N2O2
SMILES
CC(=O)N(C1=CC2=C3C(=C1)CCN3CCC2)C(=O)C
InChI
InChI=1S/C15H18N2O2/c1-10(18)17(11(2)19)14-8-12-4-3-6-16-7-5-13(9-14)15(12)16/h8-9H,3-7H2,1-2H3
InChIKey
JTBCAFOKHNQXTJ-UHFFFAOYSA-N
Compound name
N-acetyl-N-(1-azatricyclo[6.3.1.04,12]dodeca-4,6,8(12)-trien-6-yl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

258.13684 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 259.14412 159.9
[M+Na]+ 281.12606 165.2
[M-H]- 257.12956 163.9
[M+NH4]+ 276.17066 179.6
[M+K]+ 297.10000 163.3
[M+H-H2O]+ 241.13410 152.8
[M+HCOO]- 303.13504 177.5
[M+CH3COO]- 317.15069 202.7
[M+Na-2H]- 279.11151 161.9
[M]+ 258.13629 159.6
[M]- 258.13739 159.6
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.