CID 211122

22331-78-8

Structural Information

Molecular Formula
C13H21NO
SMILES
CC(C)NC(C)CC1=CC=CC=C1OC
InChI
InChI=1S/C13H21NO/c1-10(2)14-11(3)9-12-7-5-6-8-13(12)15-4/h5-8,10-11,14H,9H2,1-4H3
InChIKey
VIWVDXYATJDPPN-UHFFFAOYSA-N
Compound name
1-(2-methoxyphenyl)-N-propan-2-ylpropan-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

207.16231 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 208.16959 149.9
[M+Na]+ 230.15153 161.1
[M+NH4]+ 225.19613 158.2
[M+K]+ 246.12547 154.7
[M-H]- 206.15503 152.6
[M+Na-2H]- 228.13698 156.0
[M]+ 207.16176 152.2
[M]- 207.16286 152.2
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

No patent data available for this compound.