CID 105571446

Rac-4-[(3r,4r)-4-methylpyrrolidine-3-carbonyl]morpholine hydrochloride

Structural Information

Molecular Formula
C10H18N2O2
SMILES
C[C@@H]1CNC[C@H]1C(=O)N2CCOCC2
InChI
InChI=1S/C10H18N2O2/c1-8-6-11-7-9(8)10(13)12-2-4-14-5-3-12/h8-9,11H,2-7H2,1H3/t8-,9-/m1/s1
InChIKey
XKJNFGXYEDMIEM-RKDXNWHRSA-N
Compound name
[(3S,4S)-4-methylpyrrolidin-3-yl]-morpholin-4-ylmethanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

198.13683 Da
Monoisotopic Mass

-0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 199.14411 147.3
[M+Na]+ 221.12605 151.0
[M-H]- 197.12955 149.2
[M+NH4]+ 216.17065 163.0
[M+K]+ 237.09999 150.1
[M+H-H2O]+ 181.13409 139.5
[M+HCOO]- 243.13503 161.1
[M+CH3COO]- 257.15068 179.1
[M+Na-2H]- 219.11150 148.0
[M]+ 198.13628 140.1
[M]- 198.13738 140.1
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

No patent data available for this compound.