CID 63930530

2-[(cycloheptylideneamino)oxy]acetic acid

Structural Information

Molecular Formula
C9H15NO3
SMILES
C1CCCC(=NOCC(=O)O)CC1
InChI
InChI=1S/C9H15NO3/c11-9(12)7-13-10-8-5-3-1-2-4-6-8/h1-7H2,(H,11,12)
InChIKey
UBJYWEPKULSKSZ-UHFFFAOYSA-N
Compound name
2-(cycloheptylideneamino)oxyacetic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

185.1052 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 186.11248 138.2
[M+Na]+ 208.09442 144.6
[M+NH4]+ 203.13902 144.5
[M+K]+ 224.06836 141.7
[M-H]- 184.09792 138.7
[M+Na-2H]- 206.07987 142.0
[M]+ 185.10465 138.8
[M]- 185.10575 138.8
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.