CID 28364

17164-65-7

Structural Information

Molecular Formula
C11H13Cl2NO2
SMILES
CC1(COC(OC1)C2=CC(=C(C=C2)Cl)Cl)N
InChI
InChI=1S/C11H13Cl2NO2/c1-11(14)5-15-10(16-6-11)7-2-3-8(12)9(13)4-7/h2-4,10H,5-6,14H2,1H3
InChIKey
RYRMQVSKHWRIGN-UHFFFAOYSA-N
Compound name
2-(3,4-dichlorophenyl)-5-methyl-1,3-dioxan-5-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

261.03235 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 262.03963 153.8
[M+Na]+ 284.02157 168.3
[M+NH4]+ 279.06617 164.3
[M+K]+ 299.99551 159.5
[M-H]- 260.02507 160.9
[M+Na-2H]- 282.00702 161.7
[M]+ 261.03180 158.7
[M]- 261.03290 158.7
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.