CID 223319

1220-78-6

Structural Information

Molecular Formula
C15H18N2O2
SMILES
CC(C)(C1=CC(=C(C=C1)O)N)C2=CC(=C(C=C2)O)N
InChI
InChI=1S/C15H18N2O2/c1-15(2,9-3-5-13(18)11(16)7-9)10-4-6-14(19)12(17)8-10/h3-8,18-19H,16-17H2,1-2H3
InChIKey
UHIDYCYNRPVZCK-UHFFFAOYSA-N
Compound name
2-amino-4-[2-(3-amino-4-hydroxyphenyl)propan-2-yl]phenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

5237
Patents

258.13684 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 259.14412 160.9
[M+Na]+ 281.12606 172.6
[M+NH4]+ 276.17066 168.0
[M+K]+ 297.10000 167.6
[M-H]- 257.12956 164.7
[M+Na-2H]- 279.11151 167.6
[M]+ 258.13629 163.6
[M]- 258.13739 163.6
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