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]+ 225.13863 151.8
[M+Na]+ 247.12057 159.4
[M-H]- 223.12407 155.1
[M+NH4]+ 242.16517 172.8
[M+K]+ 263.09451 154.6
[M+H-H2O]+ 207.12861 144.8
[M+HCOO]- 269.12955 172.5
[M+CH3COO]- 283.14520 164.0
[M+Na-2H]- 245.10602 157.6
[M]+ 224.13080 151.8
[M]- 224.13190 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.