CID 58601

Nsc665677

Structural Information

Molecular Formula
C17H17N3
SMILES
CC(=NC1=C2C=CC=CC2=NC3=CC=CC=C31)N(C)C
InChI
InChI=1S/C17H17N3/c1-12(20(2)3)18-17-13-8-4-6-10-15(13)19-16-11-7-5-9-14(16)17/h4-11H,1-3H3
InChIKey
XDBBURYSKRHHLN-UHFFFAOYSA-N
Compound name
N'-acridin-9-yl-N,N-dimethylethanimidamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

263.14224 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 264.149516 160.3
[M+Na]+ 286.131458 168.8
[M-H]- 262.134964 167.3
[M+NH4]+ 281.176063 178.6
[M+K]+ 302.105398 165.1
[M+H-H2O]+ 246.139500 151.3
[M+HCOO]- 308.140441 185.1
[M+CH3COO]- 322.156091 173.1
[M+Na-2H]- 284.116906 169.6
[M]+ 263.14169142 163.3
[M]- 263.14278858 163.3
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.