CID 3052690

69226-21-7

Structural Information

Molecular Formula
C8H15NOS
SMILES
CCCC1C(=S)NC(CO1)C
InChI
InChI=1S/C8H15NOS/c1-3-4-7-8(11)9-6(2)5-10-7/h6-7H,3-5H2,1-2H3,(H,9,11)
InChIKey
MAQFSOVELHTPLF-UHFFFAOYSA-N
Compound name
5-methyl-2-propylmorpholine-3-thione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

173.08743 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 174.09471 137.0
[M+Na]+ 196.07665 143.8
[M-H]- 172.08015 138.3
[M+NH4]+ 191.12125 155.0
[M+K]+ 212.05059 141.7
[M+H-H2O]+ 156.08469 131.4
[M+HCOO]- 218.08563 149.1
[M+CH3COO]- 232.10128 176.6
[M+Na-2H]- 194.06210 138.5
[M]+ 173.08688 135.2
[M]- 173.08798 135.2
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.