CID 213711

Benzamide, n-(10,11-dihydro-5h-dibenzo(a,d)cyclohepten-5-yl)-

Structural Information

Molecular Formula
C22H19NO
SMILES
C1CC2=CC=CC=C2C(C3=CC=CC=C31)NC(=O)C4=CC=CC=C4
InChI
InChI=1S/C22H19NO/c24-22(18-10-2-1-3-11-18)23-21-19-12-6-4-8-16(19)14-15-17-9-5-7-13-20(17)21/h1-13,21H,14-15H2,(H,23,24)
InChIKey
ICHTWPDZKRJOMD-UHFFFAOYSA-N
Compound name
N-(2-tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,11,13-hexaenyl)benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

313.14667 Da
Monoisotopic Mass

4.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 314.15395 174.3
[M+Na]+ 336.13589 179.4
[M-H]- 312.13939 183.2
[M+NH4]+ 331.18049 189.3
[M+K]+ 352.10983 177.6
[M+H-H2O]+ 296.14393 168.1
[M+HCOO]- 358.14487 193.9
[M+CH3COO]- 372.16052 184.5
[M+Na-2H]- 334.12134 180.5
[M]+ 313.14612 169.4
[M]- 313.14722 169.4
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.