CID 98252

58588-70-8

Structural Information

Molecular Formula
C15H26N3OP
SMILES
CC1CN1P(=O)(N(CC=C)CC=C)N(CC=C)CC=C
InChI
InChI=1S/C15H26N3OP/c1-6-10-16(11-7-2)20(19,18-14-15(18)5)17(12-8-3)13-9-4/h6-9,15H,1-4,10-14H2,5H3
InChIKey
OICNAMFONJFATK-UHFFFAOYSA-N
Compound name
N-[[bis(prop-2-enyl)amino]-(2-methylaziridin-1-yl)phosphoryl]-N-prop-2-enylprop-2-en-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

3
Patents

295.18134 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 296.18862 169.9
[M+Na]+ 318.17056 178.1
[M+NH4]+ 313.21516 175.0
[M+K]+ 334.14450 174.5
[M-H]- 294.17406 176.0
[M+Na-2H]- 316.15601 174.1
[M]+ 295.18079 173.3
[M]- 295.18189 173.3
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe