CID 10877928

2,3-dichloro-n-ethylaniline hydrochloride

Structural Information

Molecular Formula
C8H9Cl2N
SMILES
CCNC1=C(C(=CC=C1)Cl)Cl
InChI
InChI=1S/C8H9Cl2N/c1-2-11-7-5-3-4-6(9)8(7)10/h3-5,11H,2H2,1H3
InChIKey
BJHDRDSESRROKS-UHFFFAOYSA-N
Compound name
2,3-dichloro-N-ethylaniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

16
Patents

189.0112 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 190.01848 135.1
[M+Na]+ 212.00042 150.1
[M+NH4]+ 207.04502 145.3
[M+K]+ 227.97436 141.5
[M-H]- 188.00392 138.7
[M+Na-2H]- 209.98587 143.5
[M]+ 189.01065 139.0
[M]- 189.01175 139.0
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