CID 326817

Nsc299097

Structural Information

Molecular Formula
C13H17N3
SMILES
CN(C)C1=CC2=C(C=C1)C=CC(=N2)N(C)C
InChI
InChI=1S/C13H17N3/c1-15(2)11-7-5-10-6-8-13(16(3)4)14-12(10)9-11/h5-9H,1-4H3
InChIKey
BJMKWCAYYIEIQS-UHFFFAOYSA-N
Compound name
2-N,2-N,7-N,7-N-tetramethylquinoline-2,7-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

215.14224 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 216.14952 148.7
[M+Na]+ 238.13146 156.3
[M-H]- 214.13496 154.8
[M+NH4]+ 233.17606 168.1
[M+K]+ 254.10540 155.1
[M+H-H2O]+ 198.13950 140.6
[M+HCOO]- 260.14044 173.5
[M+CH3COO]- 274.15609 202.4
[M+Na-2H]- 236.11691 155.9
[M]+ 215.14169 151.1
[M]- 215.14279 151.1
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.