CID 124603411

(2s)-2-(bromomethyl)morpholine hydrochloride

Structural Information

Molecular Formula
C5H10BrNO
SMILES
C1CO[C@@H](CN1)CBr
InChI
InChI=1S/C5H10BrNO/c6-3-5-4-7-1-2-8-5/h5,7H,1-4H2/t5-/m1/s1
InChIKey
ZPSJVTJYARPZFC-RXMQYKEDSA-N
Compound name
(2S)-2-(bromomethyl)morpholine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

178.99458 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 180.001856 131.4
[M+Na]+ 201.983798 140.2
[M-H]- 177.987304 134.8
[M+NH4]+ 197.028403 151.5
[M+K]+ 217.957738 131.3
[M+H-H2O]+ 161.991840 131.5
[M+HCOO]- 223.992781 147.2
[M+CH3COO]- 238.008431 173.5
[M+Na-2H]- 199.969246 139.9
[M]+ 178.99403142 145.1
[M]- 178.99512858 145.1
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.