CID 91892

1-(4-methoxyphenyl)-2-methylpropan-2-amine

Structural Information

Molecular Formula
C11H17NO
SMILES
CC(C)(CC1=CC=C(C=C1)OC)N
InChI
InChI=1S/C11H17NO/c1-11(2,12)8-9-4-6-10(13-3)7-5-9/h4-7H,8,12H2,1-3H3
InChIKey
DUMKDWRRTLFHTA-UHFFFAOYSA-N
Compound name
1-(4-methoxyphenyl)-2-methylpropan-2-amine
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

1
References

226
Patents

179.13101 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 180.13829 140.7
[M+Na]+ 202.12023 152.4
[M+NH4]+ 197.16483 149.2
[M+K]+ 218.09417 146.4
[M-H]- 178.12373 143.1
[M+Na-2H]- 200.10568 147.5
[M]+ 179.13046 143.1
[M]- 179.13156 143.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe