CID 57370219

15788-14-4

Structural Information

Molecular Formula
C8H12N2O
SMILES
C1=CC(=C(C=C1CCO)N)N
InChI
InChI=1S/C8H12N2O/c9-7-2-1-6(3-4-11)5-8(7)10/h1-2,5,11H,3-4,9-10H2
InChIKey
JBRDLNMAUMZCPN-UHFFFAOYSA-N
Compound name
2-(3,4-diaminophenyl)ethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

12
Patents

152.09496 Da
Monoisotopic Mass

-0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 153.10224 131.0
[M+Na]+ 175.08418 141.7
[M+NH4]+ 170.12878 139.1
[M+K]+ 191.05812 136.3
[M-H]- 151.08768 133.6
[M+Na-2H]- 173.06963 136.9
[M]+ 152.09441 132.9
[M]- 152.09551 132.9
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