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

54
Patents

224.13135 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 225.13863 148.9
[M+Na]+ 247.12057 155.4
[M-H]- 223.12407 152.4
[M+NH4]+ 242.16517 166.0
[M+K]+ 263.09451 153.7
[M+H-H2O]+ 207.12861 143.1
[M+HCOO]- 269.12955 167.1
[M+CH3COO]- 283.14520 159.9
[M+Na-2H]- 245.10602 156.6
[M]+ 224.13080 142.3
[M]- 224.13190 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