CID 14989941

3-(4-methoxyphenyl)-2-methylpropane-1,2-diamine

Structural Information

Molecular Formula
C11H18N2O
SMILES
CC(CC1=CC=C(C=C1)OC)(CN)N
InChI
InChI=1S/C11H18N2O/c1-11(13,8-12)7-9-3-5-10(14-2)6-4-9/h3-6H,7-8,12-13H2,1-2H3
InChIKey
MDBPTEVGPIYLQS-UHFFFAOYSA-N
Compound name
3-(4-methoxyphenyl)-2-methylpropane-1,2-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

37
Patents

194.1419 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 195.14918 144.8
[M+Na]+ 217.13112 154.7
[M+NH4]+ 212.17572 152.5
[M+K]+ 233.10506 149.4
[M-H]- 193.13462 147.1
[M+Na-2H]- 215.11657 150.6
[M]+ 194.14135 146.7
[M]- 194.14245 146.7
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