CID 21116254

Ns00052252

Structural Information

Molecular Formula
C4H8ClNO
SMILES
CC(C)(/C=N/O)Cl
InChI
InChI=1S/C4H8ClNO/c1-4(2,5)3-6-7/h3,7H,1-2H3/b6-3+
InChIKey
SZGTXZBWWMKXMH-ZZXKWVIFSA-N
Compound name
(NE)-N-(2-chloro-2-methylpropylidene)hydroxylamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

121.02944 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 122.036716 121.8
[M+Na]+ 144.018658 130.5
[M-H]- 120.022164 122.6
[M+NH4]+ 139.063263 145.0
[M+K]+ 159.992598 128.8
[M+H-H2O]+ 104.026700 118.9
[M+HCOO]- 166.027641 141.6
[M+CH3COO]- 180.043291 170.4
[M+Na-2H]- 142.004106 130.2
[M]+ 121.02889142 123.4
[M]- 121.02998858 123.4
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.