CID 7081

3,6-acridinediamine, 2,7-dimethyl-

Structural Information

Molecular Formula
C15H15N3
SMILES
CC1=CC2=CC3=C(C=C(C(=C3)C)N)N=C2C=C1N
InChI
InChI=1S/C15H15N3/c1-8-3-10-5-11-4-9(2)13(17)7-15(11)18-14(10)6-12(8)16/h3-7H,16-17H2,1-2H3
InChIKey
HGHJYCKSBMCGRK-UHFFFAOYSA-N
Compound name
2,7-dimethylacridine-3,6-diamine
Related CIDs

2D Structure

compound 2d structure
5
Annotation Hits

32
References

4145
Patents

237.1266 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 238.13388 154.0
[M+Na]+ 260.11582 165.8
[M-H]- 236.11932 158.6
[M+NH4]+ 255.16042 172.6
[M+K]+ 276.08976 159.8
[M+H-H2O]+ 220.12386 146.6
[M+HCOO]- 282.12480 177.0
[M+CH3COO]- 296.14045 167.1
[M+Na-2H]- 258.10127 161.6
[M]+ 237.12605 154.2
[M]- 237.12715 154.2
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

patents stripe