CID 3856267

161118-67-8

Structural Information

Molecular Formula
C16H33N4P
SMILES
CC(C)(C)N=P(N1CCCC1)(N2CCCC2)N3CCCC3
InChI
InChI=1S/C16H33N4P/c1-16(2,3)17-21(18-10-4-5-11-18,19-12-6-7-13-19)20-14-8-9-15-20/h4-15H2,1-3H3
InChIKey
PVNUIRUAPVSSOK-UHFFFAOYSA-N
Compound name
tert-butylimino(tripyrrolidin-1-yl)-lambda5-phosphane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

1103
Patents

312.2443 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 313.25158 179.6
[M+Na]+ 335.23352 179.2
[M-H]- 311.23702 183.8
[M+NH4]+ 330.27812 195.1
[M+K]+ 351.20746 178.7
[M+H-H2O]+ 295.24156 167.6
[M+HCOO]- 357.24250 198.6
[M+CH3COO]- 371.25815 207.7
[M+Na-2H]- 333.21897 174.1
[M]+ 312.24375 172.4
[M]- 312.24485 172.4
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