CID 165745354

2375273-45-1

Structural Information

Molecular Formula
C14H21Cl2NO2
SMILES
C1=C(C=C(C=C1CCl)OCCCCCCON)CCl
InChI
InChI=1S/C14H21Cl2NO2/c15-10-12-7-13(11-16)9-14(8-12)18-5-3-1-2-4-6-19-17/h7-9H,1-6,10-11,17H2
InChIKey
VNYYJYXYOTZBTC-UHFFFAOYSA-N
Compound name
O-[6-[3,5-bis(chloromethyl)phenoxy]hexyl]hydroxylamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

305.09494 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 306.10222 169.0
[M+Na]+ 328.08416 176.4
[M-H]- 304.08766 170.8
[M+NH4]+ 323.12876 185.2
[M+K]+ 344.05810 170.4
[M+H-H2O]+ 288.09220 163.7
[M+HCOO]- 350.09314 183.1
[M+CH3COO]- 364.10879 205.0
[M+Na-2H]- 326.06961 171.1
[M]+ 305.09439 175.6
[M]- 305.09549 175.6
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