CID 73022881

494227-35-9

Structural Information

Molecular Formula
C26H37NP
SMILES
CN(C)C(C1=CC=CC=C1)[C]2[CH][CH][CH][C]2P(C3CCCCC3)C4CCCCC4
InChI
InChI=1S/C26H37NP/c1-27(2)26(21-13-6-3-7-14-21)24-19-12-20-25(24)28(22-15-8-4-9-16-22)23-17-10-5-11-18-23/h3,6-7,12-14,19-20,22-23,26H,4-5,8-11,15-18H2,1-2H3
InChIKey
CNGITBDSARUMOB-UHFFFAOYSA-N
Compound name
None
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

394.26636 Da
Monoisotopic Mass

6.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 395.27364 203.1
[M+Na]+ 417.25558 197.2
[M-H]- 393.25908 211.3
[M+NH4]+ 412.30018 214.3
[M+K]+ 433.22952 193.4
[M+H-H2O]+ 377.26362 190.0
[M+HCOO]- 439.26456 219.4
[M+CH3COO]- 453.28021 229.9
[M+Na-2H]- 415.24103 190.8
[M]+ 394.26581 190.5
[M]- 394.26691 190.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.