CID 20633645

773840-83-8

Structural Information

Molecular Formula

C₁₄H₂₄N₂

SMILES

CC(C)(CN)C1=CC=C(C=C1)C(C)(C)CN

InChI

InChI=1S/C14H24N2/c1-13(2,9-15)11-5-7-12(8-6-11)14(3,4)10-16/h5-8H,9-10,15-16H2,1-4H3

InChIKey

XWKQOZODYPPIFG-UHFFFAOYSA-N

Compound name

2-[4-(1-amino-2-methylpropan-2-yl)phenyl]-2-methylpropan-1-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 14
Patents: 220.19395 Da
Monoisotopic Mass: 2.3
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	154.9
[M+Na]+	243.183168	160.4
[M-H]-	219.186674	157.4
[M+NH4]+	238.227773	172.7
[M+K]+	259.157108	157.4
[M+H-H2O]+	203.191210	149.2
[M+HCOO]-	265.192151	175.4
[M+CH3COO]-	279.207801	197.0
[M+Na-2H]-	241.168616	159.7
[M]+	220.19340142	152.5
[M]-	220.19449858	152.5

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe