CID 157010255

Structural Information

Molecular Formula
C4H12NO4P
SMILES
C[N+](C)CCOP(=O)(O)O
InChI
InChI=1S/C4H12NO4P/c1-5(2)3-4-9-10(6,7)8/h3-4H2,1-2H3,(H2,6,7,8)/q+1
InChIKey
XNORYOIOVQAIQB-UHFFFAOYSA-N
Compound name
None
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

169.0504 Da
Monoisotopic Mass

-3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 170.05768 133.9
[M+Na]+ 192.03962 140.6
[M-H]- 168.04312 132.4
[M+NH4]+ 187.08422 153.8
[M+K]+ 208.01356 136.4
[M+H-H2O]+ 152.04766 130.2
[M+HCOO]- 214.04860 161.4
[M+CH3COO]- 228.06425 171.3
[M+Na-2H]- 190.02507 140.9
[M]+ 169.04985 135.9
[M]- 169.05095 135.9
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.