CID 41338

Acridine, 4,5-bis(aminomethyl)-, dihydrochloride

Structural Information

Molecular Formula
C15H15N3
SMILES
C1=CC2=CC3=C(C(=CC=C3)CN)N=C2C(=C1)CN
InChI
InChI=1S/C15H15N3/c16-8-12-5-1-3-10-7-11-4-2-6-13(9-17)15(11)18-14(10)12/h1-7H,8-9,16-17H2
InChIKey
MSWWUTGOZYZCRT-UHFFFAOYSA-N
Compound name
[5-(aminomethyl)acridin-4-yl]methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

237.1266 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 238.133876 151.9
[M+Na]+ 260.115818 161.9
[M-H]- 236.119324 155.7
[M+NH4]+ 255.160423 169.9
[M+K]+ 276.089758 155.8
[M+H-H2O]+ 220.123860 144.2
[M+HCOO]- 282.124801 175.1
[M+CH3COO]- 296.140451 164.4
[M+Na-2H]- 258.101266 161.2
[M]+ 237.12605142 151.3
[M]- 237.12714858 151.3
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.