CID 135437511

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

Structural Information

Molecular Formula
C15H16N2
SMILES
CC(C)CN=C1C2=CC=CC3=C2C(=CC=C3)N1
InChI
InChI=1S/C15H16N2/c1-10(2)9-16-15-12-7-3-5-11-6-4-8-13(17-15)14(11)12/h3-8,10H,9H2,1-2H3,(H,16,17)
InChIKey
IMGHWABIBDILMK-UHFFFAOYSA-N
Compound name
N-(2-methylpropyl)-1H-benzo[cd]indol-2-imine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

224.13135 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 225.138626 151.8
[M+Na]+ 247.120568 159.4
[M-H]- 223.124074 155.1
[M+NH4]+ 242.165173 172.8
[M+K]+ 263.094508 154.6
[M+H-H2O]+ 207.128610 144.8
[M+HCOO]- 269.129551 172.5
[M+CH3COO]- 283.145201 164.0
[M+Na-2H]- 245.106016 157.6
[M]+ 224.13080142 151.8
[M]- 224.13189858 151.8
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.