CID 9877894

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

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

69
Patents

224.13135 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 225.138626 148.9
[M+Na]+ 247.120568 155.4
[M-H]- 223.124074 152.4
[M+NH4]+ 242.165173 166.0
[M+K]+ 263.094508 153.7
[M+H-H2O]+ 207.128610 143.1
[M+HCOO]- 269.129551 167.1
[M+CH3COO]- 283.145201 159.9
[M+Na-2H]- 245.106016 156.6
[M]+ 224.13080142 142.3
[M]- 224.13189858 142.3
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

patents stripe