CID 6365438

(2z)-2-(nitromethylidene)-1-prop-2-enylpyrrolidine

Structural Information

Molecular Formula
C8H12N2O2
SMILES
C=CCN\1CCC/C1=C/[N+](=O)[O-]
InChI
InChI=1S/C8H12N2O2/c1-2-5-9-6-3-4-8(9)7-10(11)12/h2,7H,1,3-6H2/b8-7-
InChIKey
LWWSULAJWWHYIC-FPLPWBNLSA-N
Compound name
(2Z)-2-(nitromethylidene)-1-prop-2-enylpyrrolidine
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

168.08987 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 169.09715 137.0
[M+Na]+ 191.07909 147.1
[M+NH4]+ 186.12369 144.3
[M+K]+ 207.05303 145.6
[M-H]- 167.08259 138.2
[M+Na-2H]- 189.06454 140.1
[M]+ 168.08932 138.3
[M]- 168.09042 138.3
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.