CID 28946202

4-[4-(chloromethyl)phenyl]morpholine hydrochloride

Structural Information

Molecular Formula
C11H14ClNO
SMILES
C1COCCN1C2=CC=C(C=C2)CCl
InChI
InChI=1S/C11H14ClNO/c12-9-10-1-3-11(4-2-10)13-5-7-14-8-6-13/h1-4H,5-9H2
InChIKey
VXXBDVPJUQJQIS-UHFFFAOYSA-N
Compound name
4-[4-(chloromethyl)phenyl]morpholine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

27
Patents

211.07639 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 212.08367 145.2
[M+Na]+ 234.06561 151.8
[M-H]- 210.06911 150.1
[M+NH4]+ 229.11021 161.8
[M+K]+ 250.03955 148.8
[M+H-H2O]+ 194.07365 137.9
[M+HCOO]- 256.07459 159.6
[M+CH3COO]- 270.09024 157.2
[M+Na-2H]- 232.05106 151.4
[M]+ 211.07584 143.8
[M]- 211.07694 143.8
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