CID 964807

22675-83-8

Structural Information

Molecular Formula
C12H19NO
SMILES
CC(C)(C)NCC1=CC=C(C=C1)OC
InChI
InChI=1S/C12H19NO/c1-12(2,3)13-9-10-5-7-11(14-4)8-6-10/h5-8,13H,9H2,1-4H3
InChIKey
HJTHGDULOMBYOG-UHFFFAOYSA-N
Compound name
N-[(4-methoxyphenyl)methyl]-2-methylpropan-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

71
Patents

193.14667 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 194.15395 145.3
[M+Na]+ 216.13589 157.1
[M+NH4]+ 211.18049 153.8
[M+K]+ 232.10983 150.6
[M-H]- 192.13939 147.8
[M+Na-2H]- 214.12134 152.3
[M]+ 193.14612 147.8
[M]- 193.14722 147.8
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