CID 741858

3692-67-9

Structural Information

Molecular Formula
C15H15NO3
SMILES
C1COCCN1C(=O)C2=CC3=CC=CC=C3C=C2O
InChI
InChI=1S/C15H15NO3/c17-14-10-12-4-2-1-3-11(12)9-13(14)15(18)16-5-7-19-8-6-16/h1-4,9-10,17H,5-8H2
InChIKey
UIBXWHOZQBESMO-UHFFFAOYSA-N
Compound name
(3-hydroxynaphthalen-2-yl)-morpholin-4-ylmethanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

3
Patents

257.1052 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 258.11248 157.0
[M+Na]+ 280.09442 162.9
[M-H]- 256.09792 161.9
[M+NH4]+ 275.13902 171.0
[M+K]+ 296.06836 160.3
[M+H-H2O]+ 240.10246 148.6
[M+HCOO]- 302.10340 172.5
[M+CH3COO]- 316.11905 167.7
[M+Na-2H]- 278.07987 162.4
[M]+ 257.10465 153.8
[M]- 257.10575 153.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe