PubChemLite - Hydramethylnon (C25H24F6N4)

Structural Information

Molecular Formula

SMILES

CC1(CN=C(NC1)NN=C(/C=C/C2=CC=C(C=C2)C(F)(F)F)/C=C/C3=CC=C(C=C3)C(F)(F)F)C

InChI

InChI=1S/C25H24F6N4/c1-23(2)15-32-22(33-16-23)35-34-21(13-7-17-3-9-19(10-4-17)24(26,27)28)14-8-18-5-11-20(12-6-18)25(29,30)31/h3-14H,15-16H2,1-2H3,(H2,32,33,35)/b13-7+,14-8+

InChIKey

IQVNEKKDSLOHHK-FNCQTZNRSA-N

Compound name

N-[[(1E,4E)-1,5-bis[4-(trifluoromethyl)phenyl]penta-1,4-dien-3-ylidene]amino]-5,5-dimethyl-4,6-dihydro-1H-pyrimidin-2-amine

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]+	495.19780	202.5
[M+Na]+	517.17974	206.6
[M+NH4]+	512.22434	203.6
[M+K]+	533.15368	200.4
[M-H]-	493.18324	198.1
[M+Na-2H]-	515.16519	205.3
[M]+	494.18997	201.4
[M]-	494.19107	201.4

Adduct

m/z

Predicted CCS (Å²)

[M+H]+

495.19780

202.5

[M+Na]+

517.17974

206.6

[M+NH4]+

512.22434

203.6

[M+K]+

533.15368

200.4

[M-H]-

493.18324

198.1

[M+Na-2H]-

515.16519

205.3

[M]+

494.18997

201.4

[M]-

494.19107

201.4

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

Hydramethylnon

Structural Information

2D Structure

Profile

Predicted Collision Cross Section

Literature stripe

Patent stripe