CID 16771442

2-(azepan-1-yl)-n'-hydroxyethanimidamide

Structural Information

Molecular Formula
C8H17N3O
SMILES
C1CCCN(CC1)C/C(=N/O)/N
InChI
InChI=1S/C8H17N3O/c9-8(10-12)7-11-5-3-1-2-4-6-11/h12H,1-7H2,(H2,9,10)
InChIKey
FMLZDRMKPOUTQO-UHFFFAOYSA-N
Compound name
2-(azepan-1-yl)-N'-hydroxyethanimidamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

171.13716 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 172.14444 136.7
[M+Na]+ 194.12638 142.3
[M+NH4]+ 189.17098 143.0
[M+K]+ 210.10032 139.6
[M-H]- 170.12988 137.6
[M+Na-2H]- 192.11183 140.4
[M]+ 171.13661 137.2
[M]- 171.13771 137.2
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.