CID 3060713

78219-90-6

Structural Information

Molecular Formula
C10H21Cl2N2OP
SMILES
C1CCCOP(NCC1)N(CCCl)CCCl
InChI
InChI=1S/C10H21Cl2N2OP/c11-5-8-14(9-6-12)16-13-7-3-1-2-4-10-15-16/h13H,1-10H2
InChIKey
NLNTUOTUORQHSC-UHFFFAOYSA-N
Compound name
N,N-bis(2-chloroethyl)-1,3,2-oxazaphosphonan-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

286.07684 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 287.08412 189.1
[M+Na]+ 309.06606 191.5
[M-H]- 285.06956 189.3
[M+NH4]+ 304.11066 189.6
[M+K]+ 325.04000 189.3
[M+H-H2O]+ 269.07410 181.1
[M+HCOO]- 331.07504 190.3
[M+CH3COO]- 345.09069 191.1
[M+Na-2H]- 307.05151 192.2
[M]+ 286.07629 189.8
[M]- 286.07739 189.8
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.