CID 2734549

136705-64-1

Structural Information

Molecular Formula
C22H36P2
SMILES
CC[C@@H]1CC[C@H](P1C2=CC=CC=C2P3[C@@H](CC[C@H]3CC)CC)CC
InChI
InChI=1S/C22H36P2/c1-5-17-13-14-18(6-2)23(17)21-11-9-10-12-22(21)24-19(7-3)15-16-20(24)8-4/h9-12,17-20H,5-8,13-16H2,1-4H3/t17-,18-,19-,20-/m1/s1
InChIKey
GVVCHDNSTMEUCS-UAFMIMERSA-N
Compound name
(2R,5R)-1-[2-[(2R,5R)-2,5-diethylphospholan-1-yl]phenyl]-2,5-diethylphospholane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1166
Patents

362.22922 Da
Monoisotopic Mass

5.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 363.23650 196.1
[M+Na]+ 385.21844 199.1
[M-H]- 361.22194 202.2
[M+NH4]+ 380.26304 213.4
[M+K]+ 401.19238 194.0
[M+H-H2O]+ 345.22648 184.1
[M+HCOO]- 407.22742 224.5
[M+CH3COO]- 421.24307 223.0
[M+Na-2H]- 383.20389 182.2
[M]+ 362.22867 195.0
[M]- 362.22977 195.0
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