CID 173835

4-hydroxynirvanol

Structural Information

Molecular Formula
C11H12N2O3
SMILES
CCC1(C(=O)NC(=O)N1)C2=CC=C(C=C2)O
InChI
InChI=1S/C11H12N2O3/c1-2-11(9(15)12-10(16)13-11)7-3-5-8(14)6-4-7/h3-6,14H,2H2,1H3,(H2,12,13,15,16)
InChIKey
LZFIVJCLUUNXKT-UHFFFAOYSA-N
Compound name
5-ethyl-5-(4-hydroxyphenyl)imidazolidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

2
References

4
Patents

220.0848 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 221.09208 149.1
[M+Na]+ 243.07402 159.5
[M+NH4]+ 238.11862 156.2
[M+K]+ 259.04796 155.0
[M-H]- 219.07752 148.8
[M+Na-2H]- 241.05947 154.4
[M]+ 220.08425 150.2
[M]- 220.08535 150.2
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

patents stripe