CID 275809

58286-94-5

Structural Information

Molecular Formula
C19H19NO2
SMILES
CCOC(=O)NC1CC2C3=CC=CC=C3C1C4=CC=CC=C24
InChI
InChI=1S/C19H19NO2/c1-2-22-19(21)20-17-11-16-12-7-3-5-9-14(12)18(17)15-10-6-4-8-13(15)16/h3-10,16-18H,2,11H2,1H3,(H,20,21)
InChIKey
IZHNIWLBVIDJPB-UHFFFAOYSA-N
Compound name
ethyl N-(15-tetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaenyl)carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

293.14157 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 294.14885 162.2
[M+Na]+ 316.13079 175.8
[M+NH4]+ 311.17539 173.4
[M+K]+ 332.10473 166.8
[M-H]- 292.13429 165.3
[M+Na-2H]- 314.11624 165.0
[M]+ 293.14102 165.2
[M]- 293.14212 165.2
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.