CID 585410

Schembl10391843

Structural Information

Molecular Formula

C₁₄H₂₄N₂

SMILES

CC1=C(N=C(C(=N1)CC(C)C)C)CC(C)C

InChI

InChI=1S/C14H24N2/c1-9(2)7-13-11(5)16-14(8-10(3)4)12(6)15-13/h9-10H,7-8H2,1-6H3

InChIKey

QFPSKYGXQMHPCZ-UHFFFAOYSA-N

Compound name

2,5-dimethyl-3,6-bis(2-methylpropyl)pyrazine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 45
Patents: 220.19395 Da
Monoisotopic Mass: 3.8
XlogP (predicted)

Profile

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]+	221.201226	154.3
[M+Na]+	243.183168	162.1
[M-H]-	219.186674	155.3
[M+NH4]+	238.227773	171.0
[M+K]+	259.157108	159.6
[M+H-H2O]+	203.191210	147.0
[M+HCOO]-	265.192151	172.6
[M+CH3COO]-	279.207801	197.0
[M+Na-2H]-	241.168616	155.5
[M]+	220.19340142	157.0
[M]-	220.19449858	157.0

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe