CID 3621694

Hc yellow no. 10

Structural Information

Molecular Formula
C10H14ClN3O4
SMILES
C1=C(C(=CC(=C1NCCO)Cl)[N+](=O)[O-])NCCO
InChI
InChI=1S/C10H14ClN3O4/c11-7-5-10(14(17)18)9(13-2-4-16)6-8(7)12-1-3-15/h5-6,12-13,15-16H,1-4H2
InChIKey
ZEARLPPIUCBHRP-UHFFFAOYSA-N
Compound name
2-[4-chloro-5-(2-hydroxyethylamino)-2-nitroanilino]ethanol
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

0
References

2207
Patents

275.0673 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 276.07458 156.2
[M+Na]+ 298.05652 162.1
[M-H]- 274.06002 157.1
[M+NH4]+ 293.10112 170.6
[M+K]+ 314.03046 153.8
[M+H-H2O]+ 258.06456 155.4
[M+HCOO]- 320.06550 176.4
[M+CH3COO]- 334.08115 191.6
[M+Na-2H]- 296.04197 162.2
[M]+ 275.06675 156.1
[M]- 275.06785 156.1
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