CID 6439123

Maniwamycin b

Structural Information

Molecular Formula
C10H20N2O2
SMILES
CCCC/C=C/[N+](=N[C@@H](C)[C@H](C)O)[O-]
InChI
InChI=1S/C10H20N2O2/c1-4-5-6-7-8-12(14)11-9(2)10(3)13/h7-10,13H,4-6H2,1-3H3/b8-7+,12-11?/t9-,10-/m0/s1
InChIKey
YSGFBXZSDXVSLM-IZPMOTALSA-N
Compound name
[(E)-hex-1-enyl]-[(2S,3S)-3-hydroxybutan-2-yl]imino-oxidoazanium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

0
Patents

200.15248 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 201.15976 148.1
[M+Na]+ 223.14170 156.6
[M+NH4]+ 218.18630 154.6
[M+K]+ 239.11564 154.1
[M-H]- 199.14520 148.5
[M+Na-2H]- 221.12715 149.8
[M]+ 200.15193 148.9
[M]- 200.15303 148.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.