CID 169492840

Chebi:228268

Structural Information

Molecular Formula
C5H13NO3P
SMILES
C[N+](C)(C)/C=C/P(=O)(O)O
InChI
InChI=1S/C5H12NO3P/c1-6(2,3)4-5-10(7,8)9/h4-5H,1-3H3,(H-,7,8,9)/p+1/b5-4+
InChIKey
GISKBGPLPFUURD-SNAWJCMRSA-O
Compound name
trimethyl-[(E)-2-phosphonoethenyl]azanium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

166.06331 Da
Monoisotopic Mass

-1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 167.07059 133.1
[M+Na]+ 189.05253 140.5
[M-H]- 165.05603 131.8
[M+NH4]+ 184.09713 153.6
[M+K]+ 205.02647 134.6
[M+H-H2O]+ 149.06057 130.4
[M+HCOO]- 211.06151 159.5
[M+CH3COO]- 225.07716 170.0
[M+Na-2H]- 187.03798 141.8
[M]+ 166.06276 132.9
[M]- 166.06386 132.9
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.