CID 2907

Cyclophosphamide

Structural Information

Molecular Formula

C₇H₁₅Cl₂N₂O₂P

SMILES

C1CNP(=O)(OC1)N(CCCl)CCCl

InChI

InChI=1S/C7H15Cl2N2O2P/c8-2-5-11(6-3-9)14(12)10-4-1-7-13-14/h1-7H2,(H,10,12)

InChIKey

CMSMOCZEIVJLDB-UHFFFAOYSA-N

Compound name

N,N-bis(2-chloroethyl)-2-oxo-1,3,2lambda5-oxazaphosphinan-2-amine

Related CIDs

2D Structure

compound 2d structure

8
Annotation Hits: 55413
References: 225048
Patents: 260.0248 Da
Monoisotopic Mass: 0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	261.03208	152.3
[M+Na]+	283.01402	162.1
[M+NH4]+	278.05862	160.7
[M+K]+	298.98796	154.8
[M-H]-	259.01752	153.7
[M+Na-2H]-	280.99947	157.0
[M]+	260.02425	154.4
[M]-	260.02535	154.4

Literature stripe

literature stripe

Patent stripe

patents stripe