CID 44148879

94291-62-0

Structural Information

Molecular Formula
C16H16N2
SMILES
CN=C1CC2=CC=CC=C2N(C3=CC=CC=C13)C
InChI
InChI=1S/C16H16N2/c1-17-14-11-12-7-3-5-9-15(12)18(2)16-10-6-4-8-13(14)16/h3-10H,11H2,1-2H3
InChIKey
GBGAKVVPCIFCRS-UHFFFAOYSA-N
Compound name
N,11-dimethyl-6H-benzo[b][1]benzazepin-5-imine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

236.13135 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 237.138626 152.2
[M+Na]+ 259.120568 160.2
[M-H]- 235.124074 159.0
[M+NH4]+ 254.165173 170.6
[M+K]+ 275.094508 159.5
[M+H-H2O]+ 219.128610 145.8
[M+HCOO]- 281.129551 173.6
[M+CH3COO]- 295.145201 164.6
[M+Na-2H]- 257.106016 160.3
[M]+ 236.13080142 149.7
[M]- 236.13189858 149.7
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.