CID 49760364

1119449-40-9

Structural Information

Molecular Formula
C19H18N2O3
SMILES
C1CN(CC(=O)N1)C(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24
InChI
InChI=1S/C19H18N2O3/c22-18-11-21(10-9-20-18)19(23)24-12-17-15-7-3-1-5-13(15)14-6-2-4-8-16(14)17/h1-8,17H,9-12H2,(H,20,22)
InChIKey
YQKHEDWUIMBPKY-UHFFFAOYSA-N
Compound name
9H-fluoren-9-ylmethyl 3-oxopiperazine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

12
Patents

322.13174 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 323.139016 175.4
[M+Na]+ 345.120958 181.5
[M-H]- 321.124464 179.2
[M+NH4]+ 340.165563 189.4
[M+K]+ 361.094898 175.8
[M+H-H2O]+ 305.129000 166.1
[M+HCOO]- 367.129941 189.6
[M+CH3COO]- 381.145591 184.6
[M+Na-2H]- 343.106406 177.2
[M]+ 322.13119142 172.4
[M]- 322.13228858 172.4
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

patents stripe