CID 17604319

[3-methyl-4-(morpholin-4-yl)phenyl]methanol

Structural Information

Molecular Formula
C12H17NO2
SMILES
CC1=C(C=CC(=C1)CO)N2CCOCC2
InChI
InChI=1S/C12H17NO2/c1-10-8-11(9-14)2-3-12(10)13-4-6-15-7-5-13/h2-3,8,14H,4-7,9H2,1H3
InChIKey
ZSILPVRSVMCFGX-UHFFFAOYSA-N
Compound name
(3-methyl-4-morpholin-4-ylphenyl)methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

207.12593 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 208.13321 146.9
[M+Na]+ 230.11515 152.9
[M-H]- 206.11865 151.1
[M+NH4]+ 225.15975 162.4
[M+K]+ 246.08909 151.1
[M+H-H2O]+ 190.12319 139.4
[M+HCOO]- 252.12413 164.4
[M+CH3COO]- 266.13978 183.4
[M+Na-2H]- 228.10060 152.0
[M]+ 207.12538 143.9
[M]- 207.12648 143.9
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.