CID 177071

Methylene, nitro-

Structural Information

Molecular Formula

SMILES

[CH][N+](=O)[O-]

InChI

InChI=1S/CHNO2/c1-2(3)4/h1H

InChIKey

AFMIYEXCCPCEKD-UHFFFAOYSA-N

Compound name

None

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1
Patents: 59.00073 Da
Monoisotopic Mass: 0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	60.008006	103.9
[M+Na]+	81.989948	112.6
[M-H]-	57.993454	105.2
[M+NH4]+	77.034553	128.2
[M+K]+	97.963888	110.1
[M+H-H2O]+	41.997990	105.2
[M+HCOO]-	103.99893	130.8
[M+CH3COO]-	118.01458	153.1
[M+Na-2H]-	79.975396	114.4
[M]+	59.000181	102.4
[M]-	59.001279	102.4

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe