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]+ 259.144116 159.9
[M+Na]+ 281.126058 165.2
[M-H]- 257.129564 163.9
[M+NH4]+ 276.170663 179.6
[M+K]+ 297.099998 163.3
[M+H-H2O]+ 241.134100 152.8
[M+HCOO]- 303.135041 177.5
[M+CH3COO]- 317.150691 202.7
[M+Na-2H]- 279.111506 161.9
[M]+ 258.13629142 159.6
[M]- 258.13738858 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.