CID 3626483

Bis(2-cyanoethyl) n,n-diisopropylphosphoramidite

Structural Information

Molecular Formula
C12H22N3O2P
SMILES
CC(C)N(C(C)C)P(OCCC#N)OCCC#N
InChI
InChI=1S/C12H22N3O2P/c1-11(2)15(12(3)4)18(16-9-5-7-13)17-10-6-8-14/h11-12H,5-6,9-10H2,1-4H3
InChIKey
LDHWBEHZLFDXCU-UHFFFAOYSA-N
Compound name
3-[2-cyanoethoxy-[di(propan-2-yl)amino]phosphanyl]oxypropanenitrile
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

937
Patents

271.14496 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 272.15224 157.0
[M+Na]+ 294.13418 162.8
[M-H]- 270.13768 158.6
[M+NH4]+ 289.17878 168.4
[M+K]+ 310.10812 163.7
[M+H-H2O]+ 254.14222 140.4
[M+HCOO]- 316.14316 171.8
[M+CH3COO]- 330.15881 232.3
[M+Na-2H]- 292.11963 154.8
[M]+ 271.14441 153.4
[M]- 271.14551 153.4
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