CID 58276

N'-(10,11-dihydro-5h-dibenzo(a,d)-5-cycloheptenyl)-n,n-dimethylformamidine

Structural Information

Molecular Formula
C18H20N2
SMILES
CN(C)C=NC1C2=CC=CC=C2CCC3=CC=CC=C13
InChI
InChI=1S/C18H20N2/c1-20(2)13-19-18-16-9-5-3-7-14(16)11-12-15-8-4-6-10-17(15)18/h3-10,13,18H,11-12H2,1-2H3
InChIKey
PCQJQKSPLZIGRW-UHFFFAOYSA-N
Compound name
N,N-dimethyl-N'-(2-tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,11,13-hexaenyl)methanimidamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

264.16266 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 265.169936 160.2
[M+Na]+ 287.151878 165.7
[M-H]- 263.155384 168.9
[M+NH4]+ 282.196483 178.8
[M+K]+ 303.125818 166.2
[M+H-H2O]+ 247.159920 154.2
[M+HCOO]- 309.160861 183.6
[M+CH3COO]- 323.176511 172.2
[M+Na-2H]- 285.137326 167.5
[M]+ 264.16211142 158.1
[M]- 264.16320858 158.1
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.