CID 86198

4-methyl-2-phenyl-2-(2-propynyloxy)morpholine hydrochloride

Structural Information

Molecular Formula
C14H17NO2
SMILES
CN1CCOC(C1)(C2=CC=CC=C2)OCC#C
InChI
InChI=1S/C14H17NO2/c1-3-10-16-14(12-15(2)9-11-17-14)13-7-5-4-6-8-13/h1,4-8H,9-12H2,2H3
InChIKey
MAZOCKDZPHJLKY-UHFFFAOYSA-N
Compound name
4-methyl-2-phenyl-2-prop-2-ynoxymorpholine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

231.12593 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 232.13321 149.6
[M+Na]+ 254.11515 158.5
[M-H]- 230.11865 152.6
[M+NH4]+ 249.15975 164.5
[M+K]+ 270.08909 154.0
[M+H-H2O]+ 214.12319 135.8
[M+HCOO]- 276.12413 162.7
[M+CH3COO]- 290.13978 196.0
[M+Na-2H]- 252.10060 155.0
[M]+ 231.12538 143.1
[M]- 231.12648 143.1
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.