CID 16244316

4,6-dichloro-2,3-dihydro-1h-inden-1-amine hydrochloride

Structural Information

Molecular Formula
C9H9Cl2N
SMILES
C1CC2=C(C1N)C=C(C=C2Cl)Cl
InChI
InChI=1S/C9H9Cl2N/c10-5-3-7-6(8(11)4-5)1-2-9(7)12/h3-4,9H,1-2,12H2
InChIKey
CWQMXJLBEVRHSZ-UHFFFAOYSA-N
Compound name
4,6-dichloro-2,3-dihydro-1H-inden-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

12
Patents

201.0112 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 202.01848 141.7
[M+Na]+ 224.00042 152.6
[M-H]- 200.00392 145.3
[M+NH4]+ 219.04502 165.0
[M+K]+ 239.97436 146.3
[M+H-H2O]+ 184.00846 138.2
[M+HCOO]- 246.00940 155.9
[M+CH3COO]- 260.02505 155.2
[M+Na-2H]- 221.98587 145.2
[M]+ 201.01065 142.0
[M]- 201.01175 142.0
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