CID 9877894

41218-84-2

Structural Information

Molecular Formula

C₁₅H₁₆N₂

SMILES

C1C2=CC=CC=C2C(NC3=CC=CC=C31)CN

InChI

InChI=1S/C15H16N2/c16-10-15-13-7-3-1-5-11(13)9-12-6-2-4-8-14(12)17-15/h1-8,15,17H,9-10,16H2

InChIKey

FPKDBVUHIXYLNP-UHFFFAOYSA-N

Compound name

6,11-dihydro-5H-benzo[c][1]benzazepin-6-ylmethanamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 52
Patents: 224.13135 Da
Monoisotopic Mass: 2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	225.13863	149.1
[M+Na]+	247.12057	161.0
[M+NH4]+	242.16517	158.0
[M+K]+	263.09451	154.4
[M-H]-	223.12407	152.7
[M+Na-2H]-	245.10602	155.8
[M]+	224.13080	151.9
[M]-	224.13190	151.9

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe