CID 42078860

2248202-39-1

Structural Information

Molecular Formula
C11H16N2O
SMILES
C1CO[C@H](CN1C2=CC=CC=C2)CN
InChI
InChI=1S/C11H16N2O/c12-8-11-9-13(6-7-14-11)10-4-2-1-3-5-10/h1-5,11H,6-9,12H2/t11-/m0/s1
InChIKey
YAKKATWFMLCGMI-NSHDSACASA-N
Compound name
[(2S)-4-phenylmorpholin-2-yl]methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

192.12627 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 193.133546 143.3
[M+Na]+ 215.115488 148.3
[M-H]- 191.118994 148.0
[M+NH4]+ 210.160093 159.2
[M+K]+ 231.089428 146.6
[M+H-H2O]+ 175.123530 135.2
[M+HCOO]- 237.124471 162.8
[M+CH3COO]- 251.140121 183.9
[M+Na-2H]- 213.100936 149.4
[M]+ 192.12572142 138.2
[M]- 192.12681858 138.2
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.