CID 11816821

1,3-di-tert-butyl-1,3,2-diazaphospholidine 2-oxide

Structural Information

Molecular Formula
C10H22N2OP
SMILES
CC(C)(C)N1CCN([P+]1=O)C(C)(C)C
InChI
InChI=1S/C10H22N2OP/c1-9(2,3)11-7-8-12(14(11)13)10(4,5)6/h7-8H2,1-6H3/q+1
InChIKey
RBABEMWOZLGIIE-UHFFFAOYSA-N
Compound name
1,3-ditert-butyl-1,3,2-diazaphospholidin-2-ium 2-oxide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

217.14697 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 218.15425 153.7
[M+Na]+ 240.13619 161.0
[M-H]- 216.13969 154.0
[M+NH4]+ 235.18079 172.5
[M+K]+ 256.11013 155.0
[M+H-H2O]+ 200.14423 148.8
[M+HCOO]- 262.14517 175.2
[M+CH3COO]- 276.16082 183.4
[M+Na-2H]- 238.12164 157.3
[M]+ 217.14642 153.1
[M]- 217.14752 153.1
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