CID 71374651

Dtxsid60797424

Structural Information

Molecular Formula

C₅H₁₁NO₃

SMILES

CC(=NO)C(OC)OC

InChI

InChI=1S/C5H11NO3/c1-4(6-7)5(8-2)9-3/h5,7H,1-3H3

InChIKey

WIBYEQIPBJRAPV-UHFFFAOYSA-N

Compound name

N-(1,1-dimethoxypropan-2-ylidene)hydroxylamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 2
Patents: 133.0739 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]+	134.081176	126.6
[M+Na]+	156.063118	133.2
[M-H]-	132.066624	127.2
[M+NH4]+	151.107723	148.2
[M+K]+	172.037058	135.0
[M+H-H2O]+	116.071160	121.7
[M+HCOO]-	178.072101	150.7
[M+CH3COO]-	192.087751	175.0
[M+Na-2H]-	154.048566	131.9
[M]+	133.07335142	129.0
[M]-	133.07444858	129.0

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe