CID 6510250

Bis(1-methylethyl) (chloro(hydroxyimino)methyl)phosphonate

Structural Information

Molecular Formula
C7H15ClNO4P
SMILES
CC(C)OP(=O)(/C(=N\O)/Cl)OC(C)C
InChI
InChI=1S/C7H15ClNO4P/c1-5(2)12-14(11,7(8)9-10)13-6(3)4/h5-6,10H,1-4H3/b9-7-
InChIKey
VHIGWDULHKUWOS-CLFYSBASSA-N
Compound name
(1E)-1-di(propan-2-yloxy)phosphoryl-N-hydroxymethanimidoyl chloride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

243.04272 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 244.05000 150.5
[M+Na]+ 266.03194 157.3
[M-H]- 242.03544 150.1
[M+NH4]+ 261.07654 169.3
[M+K]+ 282.00588 156.9
[M+H-H2O]+ 226.03998 144.7
[M+HCOO]- 288.04092 172.8
[M+CH3COO]- 302.05657 194.1
[M+Na-2H]- 264.01739 151.1
[M]+ 243.04217 157.0
[M]- 243.04327 157.0
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.