CID 63558207

2-methyl-4-(oxolan-3-yloxy)anilinehydrochloride

Structural Information

Molecular Formula
C11H15NO2
SMILES
CC1=C(C=CC(=C1)OC2CCOC2)N
InChI
InChI=1S/C11H15NO2/c1-8-6-9(2-3-11(8)12)14-10-4-5-13-7-10/h2-3,6,10H,4-5,7,12H2,1H3
InChIKey
IOBCUOVIEIJJOL-UHFFFAOYSA-N
Compound name
2-methyl-4-(oxolan-3-yloxy)aniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

8
Patents

193.11028 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 194.11756 142.1
[M+Na]+ 216.09950 153.4
[M+NH4]+ 211.14410 151.0
[M+K]+ 232.07344 149.5
[M-H]- 192.10300 147.5
[M+Na-2H]- 214.08495 148.3
[M]+ 193.10973 145.1
[M]- 193.11083 145.1
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