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]+ 172.144436 140.2
[M+Na]+ 194.126378 143.9
[M-H]- 170.129884 139.8
[M+NH4]+ 189.170983 157.5
[M+K]+ 210.100318 141.8
[M+H-H2O]+ 154.134420 133.5
[M+HCOO]- 216.135361 158.8
[M+CH3COO]- 230.151011 181.2
[M+Na-2H]- 192.111826 143.0
[M]+ 171.13661142 131.9
[M]- 171.13770858 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