PubChemLite - 68134-38-3 (C20H24N3)

Structural Information

Molecular Formula

C₂₀H₂₄N₃

SMILES

CC1=CC=C(C=C1)N(C)/N=C/C2=[N+](C3=CC=CC=C3C2(C)C)C

InChI

InChI=1S/C20H24N3/c1-15-10-12-16(13-11-15)23(5)21-14-19-20(2,3)17-8-6-7-9-18(17)22(19)4/h6-14H,1-5H3/q+1

InChIKey

DMAKVGLLTBTPRM-UHFFFAOYSA-N

Compound name

N,4-dimethyl-N-[(E)-(1,3,3-trimethylindol-1-ium-2-yl)methylideneamino]aniline

Related CIDs

2D Structure

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	307.20430	175.5
[M+Na]+	329.18624	184.4
[M-H]-	305.18974	185.4
[M+NH4]+	324.23084	194.9
[M+K]+	345.16018	174.7
[M+H-H2O]+	289.19428	169.4
[M+HCOO]-	351.19522	201.0
[M+CH3COO]-	365.21087	211.5
[M+Na-2H]-	327.17169	181.9
[M]+	306.19647	178.2
[M]-	306.19757	178.2

Adduct

m/z

Predicted CCS (Å²)

[M+H]+

307.20430

175.5

[M+Na]+

329.18624

184.4

[M-H]-

305.18974

185.4

[M+NH4]+

324.23084

194.9

[M+K]+

345.16018

174.7

[M+H-H2O]+

289.19428

169.4

[M+HCOO]-

351.19522

201.0

[M+CH3COO]-

365.21087

211.5

[M+Na-2H]-

327.17169

181.9

[M]+

306.19647

178.2

[M]-

306.19757

178.2

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.

68134-38-3

Structural Information

2D Structure

Profile

Predicted Collision Cross Section

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