CID 135485263

Benz(cd)indol-2-amine, n-(phenylmethyl)-, monohydrochloride

Structural Information

Molecular Formula
C18H14N2
SMILES
C1=CC=C(C=C1)CN=C2C3=CC=CC4=C3C(=CC=C4)N2
InChI
InChI=1S/C18H14N2/c1-2-6-13(7-3-1)12-19-18-15-10-4-8-14-9-5-11-16(20-18)17(14)15/h1-11H,12H2,(H,19,20)
InChIKey
SMEQVXJNVAOIFY-UHFFFAOYSA-N
Compound name
N-benzyl-1H-benzo[cd]indol-2-imine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

258.1157 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 259.12298 157.4
[M+Na]+ 281.10492 165.4
[M-H]- 257.10842 163.8
[M+NH4]+ 276.14952 176.5
[M+K]+ 297.07886 158.6
[M+H-H2O]+ 241.11296 148.9
[M+HCOO]- 303.11390 179.5
[M+CH3COO]- 317.12955 169.5
[M+Na-2H]- 279.09037 165.1
[M]+ 258.11515 156.5
[M]- 258.11625 156.5
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.