CID 3056393

1-piperazinecarboxamidine, 4-(2-hydroxyethyl)-, hemisulfate

Structural Information

Molecular Formula
C8H17N3O
SMILES
C1CN(CCC1CCO)C(=N)N
InChI
InChI=1S/C8H17N3O/c9-8(10)11-4-1-7(2-5-11)3-6-12/h7,12H,1-6H2,(H3,9,10)
InChIKey
SDMVZBFFDFADJN-UHFFFAOYSA-N
Compound name
4-(2-hydroxyethyl)piperidine-1-carboximidamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

171.13716 Da
Monoisotopic Mass

-0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 172.14444 140.2
[M+Na]+ 194.12638 143.9
[M-H]- 170.12988 139.8
[M+NH4]+ 189.17098 157.5
[M+K]+ 210.10032 141.8
[M+H-H2O]+ 154.13442 133.5
[M+HCOO]- 216.13536 158.8
[M+CH3COO]- 230.15101 181.2
[M+Na-2H]- 192.11183 143.0
[M]+ 171.13661 131.9
[M]- 171.13771 131.9
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

patents stripe