CID 203337

14185-11-6

Structural Information

Molecular Formula
C16H17Cl2NO
SMILES
CC(CN)C(C1=CC(=CC=C1)Cl)(C2=CC(=CC=C2)Cl)O
InChI
InChI=1S/C16H17Cl2NO/c1-11(10-19)16(20,12-4-2-6-14(17)8-12)13-5-3-7-15(18)9-13/h2-9,11,20H,10,19H2,1H3
InChIKey
MQBDZEZRJWNNSZ-UHFFFAOYSA-N
Compound name
3-amino-1,1-bis(3-chlorophenyl)-2-methylpropan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

309.06873 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 310.07601 172.0
[M+Na]+ 332.05795 186.3
[M+NH4]+ 327.10255 180.6
[M+K]+ 348.03189 178.2
[M-H]- 308.06145 176.1
[M+Na-2H]- 330.04340 180.2
[M]+ 309.06818 176.0
[M]- 309.06928 176.0
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

No patent data available for this compound.