CID 20633645

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

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

12
Patents

220.19395 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 221.20123 154.9
[M+Na]+ 243.18317 160.4
[M-H]- 219.18667 157.4
[M+NH4]+ 238.22777 172.7
[M+K]+ 259.15711 157.4
[M+H-H2O]+ 203.19121 149.2
[M+HCOO]- 265.19215 175.4
[M+CH3COO]- 279.20780 197.0
[M+Na-2H]- 241.16862 159.7
[M]+ 220.19340 152.5
[M]- 220.19450 152.5
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

patents stripe