CID 736209

3-amino-1-[2-(morpholin-4-yl)ethyl]thiourea

Structural Information

Molecular Formula
C7H16N4OS
SMILES
C1COCCN1CCNC(=S)NN
InChI
InChI=1S/C7H16N4OS/c8-10-7(13)9-1-2-11-3-5-12-6-4-11/h1-6,8H2,(H2,9,10,13)
InChIKey
OBGPRENQQPWJOC-UHFFFAOYSA-N
Compound name
1-amino-3-(2-morpholin-4-ylethyl)thiourea
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

26
Patents

204.10448 Da
Monoisotopic Mass

-1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 205.11176 144.4
[M+Na]+ 227.09370 147.3
[M-H]- 203.09720 145.6
[M+NH4]+ 222.13830 159.7
[M+K]+ 243.06764 145.9
[M+H-H2O]+ 187.10174 136.6
[M+HCOO]- 249.10268 159.5
[M+CH3COO]- 263.11833 187.8
[M+Na-2H]- 225.07915 147.5
[M]+ 204.10393 139.1
[M]- 204.10503 139.1
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